From 43b42bca20b5c04e0251fd16218f9c70954a338c Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Fri, 7 Aug 2015 10:34:14 +0700 Subject: [PATCH 01/43] Added Jupyter notebook with tally arithmetic examples --- docs/source/conf.py | 3 +- .../pythonapi/examples/tally-arithmetic.ipynb | 1512 +++++++++++++++++ .../pythonapi/examples/tally-arithmetic.rst | 11 + docs/source/pythonapi/index.rst | 11 +- docs/sphinxext/LICENSE | 68 + docs/sphinxext/notebook_sphinxext.py | 120 ++ 6 files changed, 1721 insertions(+), 4 deletions(-) create mode 100644 docs/source/pythonapi/examples/tally-arithmetic.ipynb create mode 100644 docs/source/pythonapi/examples/tally-arithmetic.rst create mode 100644 docs/sphinxext/LICENSE create mode 100644 docs/sphinxext/notebook_sphinxext.py diff --git a/docs/source/conf.py b/docs/source/conf.py index 8af607a4b..65ee4db6f 100644 --- a/docs/source/conf.py +++ b/docs/source/conf.py @@ -28,7 +28,8 @@ extensions = ['sphinx.ext.autodoc', 'sphinx.ext.napoleon', 'sphinx.ext.pngmath', 'sphinxcontrib.tikz', - 'sphinx_numfig'] + 'sphinx_numfig', + 'notebook_sphinxext'] # Add any paths that contain templates here, relative to this directory. templates_path = ['_templates'] diff --git a/docs/source/pythonapi/examples/tally-arithmetic.ipynb b/docs/source/pythonapi/examples/tally-arithmetic.ipynb new file mode 100644 index 000000000..3223f23aa --- /dev/null +++ b/docs/source/pythonapi/examples/tally-arithmetic.ipynb @@ -0,0 +1,1512 @@ +{ + "cells": [ + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "This notebook shows the how tallies can be combined (added, subtracted, multiplied, etc.) using the Python API in order to create derived tallies. Since no covariance information is obtained, it is assumed that tallies are completely independent of one another when propagating uncertainties. The target problem is a simple pin cell.\n", + "\n", + "**Note:** that this Notebook was created using the latest Pandas v0.16.1. Everything in the Notebook will wun with older versions of Pandas, but the multi-indexing option in >v0.15.0 makes the tables look prettier." + ] + }, + { + "cell_type": "code", + "execution_count": 1, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "%load_ext autoreload\n", + "%autoreload 2" + ] + }, + { + "cell_type": "code", + "execution_count": 2, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "import glob\n", + "from IPython.display import Image\n", + "import numpy as np\n", + "\n", + "import openmc\n", + "from openmc.statepoint import StatePoint\n", + "from openmc.summary import Summary\n", + "\n", + "%matplotlib inline" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Generate Input Files" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "First we need to define materials that will be used in the problem. Before defining a material, we must create nuclides that are used in the material." + ] + }, + { + "cell_type": "code", + "execution_count": 3, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# Instantiate some Nuclides\n", + "h1 = openmc.Nuclide('H-1')\n", + "b10 = openmc.Nuclide('B-10')\n", + "o16 = openmc.Nuclide('O-16')\n", + "u235 = openmc.Nuclide('U-235')\n", + "u238 = openmc.Nuclide('U-238')\n", + "zr90 = openmc.Nuclide('Zr-90')" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "With the nuclides we defined, we will now create three materials for the fuel, water, and cladding of the fuel pin." + ] + }, + { + "cell_type": "code", + "execution_count": 4, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# 1.6 enriched fuel\n", + "fuel = openmc.Material(name='1.6% Fuel')\n", + "fuel.set_density('g/cm3', 10.31341)\n", + "fuel.add_nuclide(u235, 3.7503e-4)\n", + "fuel.add_nuclide(u238, 2.2625e-2)\n", + "fuel.add_nuclide(o16, 4.6007e-2)\n", + "\n", + "# borated water\n", + "water = openmc.Material(name='Borated Water')\n", + "water.set_density('g/cm3', 0.740582)\n", + "water.add_nuclide(h1, 4.9457e-2)\n", + "water.add_nuclide(o16, 2.4732e-2)\n", + "water.add_nuclide(b10, 8.0042e-6)\n", + "\n", + "# zircaloy\n", + "zircaloy = openmc.Material(name='Zircaloy')\n", + "zircaloy.set_density('g/cm3', 6.55)\n", + "zircaloy.add_nuclide(zr90, 7.2758e-3)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "With our three materials, we can now create a materials file object that can be exported to an actual XML file." + ] + }, + { + "cell_type": "code", + "execution_count": 5, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Instantiate a MaterialsFile, add Materials\n", + "materials_file = openmc.MaterialsFile()\n", + "materials_file.add_material(fuel)\n", + "materials_file.add_material(water)\n", + "materials_file.add_material(zircaloy)\n", + "materials_file.default_xs = '71c'\n", + "\n", + "# Export to \"materials.xml\"\n", + "materials_file.export_to_xml()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Now let's move on to the geometry. Our problem will have three regions for the fuel, the clad, and the surrounding coolant. The first step is to create the bounding surfaces -- in this case two cylinders and six reflective planes." + ] + }, + { + "cell_type": "code", + "execution_count": 6, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Create cylinders for the fuel and clad\n", + "fuel_outer_radius = openmc.ZCylinder(x0=0.0, y0=0.0, R=0.39218)\n", + "clad_outer_radius = openmc.ZCylinder(x0=0.0, y0=0.0, R=0.45720)\n", + "\n", + "# Create boundary planes to surround the geometry\n", + "# Use both reflective and vacuum boundaries to make life interesting\n", + "min_x = openmc.XPlane(x0=-0.63, boundary_type='reflective')\n", + "max_x = openmc.XPlane(x0=+0.63, boundary_type='reflective')\n", + "min_y = openmc.YPlane(y0=-0.63, boundary_type='reflective')\n", + "max_y = openmc.YPlane(y0=+0.63, boundary_type='reflective')\n", + "min_z = openmc.ZPlane(z0=-0.63, boundary_type='reflective')\n", + "max_z = openmc.ZPlane(z0=+0.63, boundary_type='reflective')" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "With the surfaces defined, we can now create cells that are defined by intersections of half-spaces created by the surfaces." + ] + }, + { + "cell_type": "code", + "execution_count": 7, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Create a Universe to encapsulate a fuel pin\n", + "pin_cell_universe = openmc.Universe(name='1.6% Fuel Pin')\n", + "\n", + "# Create fuel Cell\n", + "fuel_cell = openmc.Cell(name='1.6% Fuel')\n", + "fuel_cell.fill = fuel\n", + "fuel_cell.add_surface(fuel_outer_radius, halfspace=-1)\n", + "pin_cell_universe.add_cell(fuel_cell)\n", + "\n", + "# Create a clad Cell\n", + "clad_cell = openmc.Cell(name='1.6% Clad')\n", + "clad_cell.fill = zircaloy\n", + "clad_cell.add_surface(fuel_outer_radius, halfspace=+1)\n", + "clad_cell.add_surface(clad_outer_radius, halfspace=-1)\n", + "pin_cell_universe.add_cell(clad_cell)\n", + "\n", + "# Create a moderator Cell\n", + "moderator_cell = openmc.Cell(name='1.6% Moderator')\n", + "moderator_cell.fill = water\n", + "moderator_cell.add_surface(clad_outer_radius, halfspace=+1)\n", + "pin_cell_universe.add_cell(moderator_cell)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "OpenMC requires that there is a \"root\" universe. Let us create a root cell that is filled by the pin cell universe and then assign it to the root universe." + ] + }, + { + "cell_type": "code", + "execution_count": 8, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Create root Cell\n", + "root_cell = openmc.Cell(name='root cell')\n", + "root_cell.fill = pin_cell_universe\n", + "\n", + "# Add boundary planes\n", + "root_cell.add_surface(min_x, halfspace=+1)\n", + "root_cell.add_surface(max_x, halfspace=-1)\n", + "root_cell.add_surface(min_y, halfspace=+1)\n", + "root_cell.add_surface(max_y, halfspace=-1)\n", + "root_cell.add_surface(min_z, halfspace=+1)\n", + "root_cell.add_surface(max_z, halfspace=-1)\n", + "\n", + "# Create root Universe\n", + "root_universe = openmc.Universe(universe_id=0, name='root universe')\n", + "root_universe.add_cell(root_cell)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "We now must create a geometry that is assigned a root universe, put the geometry into a geometry file, and export it to XML." + ] + }, + { + "cell_type": "code", + "execution_count": 9, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Create Geometry and set root Universe\n", + "geometry = openmc.Geometry()\n", + "geometry.root_universe = root_universe" + ] + }, + { + "cell_type": "code", + "execution_count": 10, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Instantiate a GeometryFile\n", + "geometry_file = openmc.GeometryFile()\n", + "geometry_file.geometry = geometry\n", + "\n", + "# Export to \"geometry.xml\"\n", + "geometry_file.export_to_xml()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "With the geometry and materials finished, we now just need to define simulation parameters. In this case, we will use 5 inactive batches and 15 active batches each with 2500 particles." + ] + }, + { + "cell_type": "code", + "execution_count": 11, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# OpenMC simulation parameters\n", + "batches = 20\n", + "inactive = 5\n", + "particles = 2500\n", + "\n", + "# Instantiate a SettingsFile\n", + "settings_file = openmc.SettingsFile()\n", + "settings_file.batches = batches\n", + "settings_file.inactive = inactive\n", + "settings_file.particles = particles\n", + "settings_file.output = {'tallies': True, 'summary': True}\n", + "source_bounds = [-0.63, -0.63, -10, 0.63, 0.63, 10.]\n", + "settings_file.set_source_space('box', source_bounds)\n", + "\n", + "# Export to \"settings.xml\"\n", + "settings_file.export_to_xml()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Let us also create a plot file that we can use to verify that our pin cell geometry was created successfully." + ] + }, + { + "cell_type": "code", + "execution_count": 12, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Instantiate a Plot\n", + "plot = openmc.Plot(plot_id=1)\n", + "plot.filename = 'materials-xy'\n", + "plot.origin = [0, 0, 0]\n", + "plot.width = [1.26, 1.26]\n", + "plot.pixels = [250, 250]\n", + "plot.color = 'mat'\n", + "\n", + "# Instantiate a PlotsFile, add Plot, and export to \"plots.xml\"\n", + "plot_file = openmc.PlotsFile()\n", + "plot_file.add_plot(plot)\n", + "plot_file.export_to_xml()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "With the plots.xml file, we can now generate and view the plot. OpenMC outputs plots in .ppm format, which can be converted into a compressed format like .png with the convert utility." + ] + }, + { + "cell_type": "code", + "execution_count": 13, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Run openmc in plotting mode\n", + "executor = openmc.Executor()\n", + "executor.plot_geometry(output=False)\n", + "\n", + "# Convert OpenMC's funky ppm to png\n", + "!convert materials-xy.ppm materials-xy.png" + ] + }, + { + "cell_type": "code", + "execution_count": 14, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "image/png": "iVBORw0KGgoAAAANSUhEUgAAAPoAAAD6AgMAAAD1grKuAAAABGdBTUEAALGPC/xhBQAAAAFzUkdC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\nVDE2OjQzOjEzKzA3OjAwHAywQgAAAABJRU5ErkJggg==\n", + "text/plain": [ + "" + ] + }, + "execution_count": 14, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Display the materials plot inline\n", + "Image(filename='materials-xy.png')" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "As we can see from the plot, we have a nice pin cell with fuel, cladding, and water! Before we run our simulation, we need to tell the code what we want to tally. The following code shows how to create a variety of tallies." + ] + }, + { + "cell_type": "code", + "execution_count": 15, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# Instantiate an empty TalliesFile\n", + "tallies_file = openmc.TalliesFile()\n", + "tallies_file.tallies = []" + ] + }, + { + "cell_type": "code", + "execution_count": 16, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Create Tallies to compute microscopic multi-group cross-sections\n", + "\n", + "# Instantiate energy filter for multi-group cross-section Tallies\n", + "energy_filter = openmc.Filter(type='energy', bins=[0., 0.625e-6, 20.])\n", + "\n", + "# Instantiate flux Tally in moderator and fuel\n", + "tally = openmc.Tally(name='flux')\n", + "tally.add_filter(openmc.Filter(type='cell', bins=[fuel_cell.id, moderator_cell.id]))\n", + "tally.add_filter(energy_filter)\n", + "tally.add_score('flux')\n", + "tallies_file.add_tally(tally)\n", + "\n", + "# Instantiate reaction rate Tally in fuel\n", + "tally = openmc.Tally(name='fuel rxn rates')\n", + "tally.add_filter(openmc.Filter(type='cell', bins=[fuel_cell.id]))\n", + "tally.add_filter(energy_filter)\n", + "tally.add_score('nu-fission')\n", + "tally.add_score('scatter')\n", + "tally.add_nuclide(u238)\n", + "tally.add_nuclide(u235)\n", + "tallies_file.add_tally(tally)\n", + "\n", + "# Instantiate reaction rate Tally in moderator\n", + "tally = openmc.Tally(name='moderator rxn rates')\n", + "tally.add_filter(openmc.Filter(type='cell', bins=[moderator_cell.id]))\n", + "tally.add_filter(energy_filter)\n", + "tally.add_score('absorption')\n", + "tally.add_score('total')\n", + "tally.add_nuclide(o16)\n", + "tally.add_nuclide(h1)\n", + "tallies_file.add_tally(tally)" + ] + }, + { + "cell_type": "code", + "execution_count": 17, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# K-Eigenvalue (infinity) tallies\n", + "fiss_rate = openmc.Tally(name='fiss. rate')\n", + "abs_rate = openmc.Tally(name='abs. rate')\n", + "fiss_rate.add_score('nu-fission')\n", + "abs_rate.add_score('absorption')\n", + "tallies_file.add_tally(fiss_rate)\n", + "tallies_file.add_tally(abs_rate)" + ] + }, + { + "cell_type": "code", + "execution_count": 18, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Resonance Escape Probability tallies\n", + "therm_abs_rate = openmc.Tally(name='therm. abs. rate')\n", + "therm_abs_rate.add_score('absorption')\n", + "therm_abs_rate.add_filter(openmc.Filter(type='energy', bins=[0., 0.625]))\n", + "tallies_file.add_tally(therm_abs_rate)" + ] + }, + { + "cell_type": "code", + "execution_count": 19, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Thermal Flux Utilization tallies\n", + "fuel_therm_abs_rate = openmc.Tally(name='fuel therm. abs. rate')\n", + "fuel_therm_abs_rate.add_score('absorption')\n", + "fuel_therm_abs_rate.add_filter(openmc.Filter(type='energy', bins=[0., 0.625]))\n", + "fuel_therm_abs_rate.add_filter(openmc.Filter(type='cell', bins=[fuel_cell.id]))\n", + "tallies_file.add_tally(fuel_therm_abs_rate)" + ] + }, + { + "cell_type": "code", + "execution_count": 20, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# Fast Fission Factor tallies\n", + "therm_fiss_rate = openmc.Tally(name='therm. fiss. rate')\n", + "tot_fiss_rate = openmc.Tally(name='tot. fiss. rate')\n", + "therm_fiss_rate.add_score('fission')\n", + "tot_fiss_rate.add_score('fission')\n", + "therm_fiss_rate.add_filter(openmc.Filter(type='energy', bins=[0., 0.625]))\n", + "tallies_file.add_tally(therm_fiss_rate)\n", + "tallies_file.add_tally(tot_fiss_rate)" + ] + }, + { + "cell_type": "code", + "execution_count": 21, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# Instantiate energy filter to illustrate Tally slicing\n", + "energy_filter = openmc.Filter(type='energy', bins=np.logspace(np.log10(1e-8), np.log10(20), 10))\n", + "\n", + "# Instantiate flux Tally in moderator and fuel\n", + "tally = openmc.Tally(name='need-to-slice')\n", + "tally.add_filter(openmc.Filter(type='cell', bins=[fuel_cell.id, moderator_cell.id]))\n", + "tally.add_filter(energy_filter)\n", + "tally.add_score('nu-fission')\n", + "tally.add_score('scatter')\n", + "tally.add_nuclide(h1)\n", + "tally.add_nuclide(u238)\n", + "tallies_file.add_tally(tally)" + ] + }, + { + "cell_type": "code", + "execution_count": 22, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# Export to \"tallies.xml\"\n", + "tallies_file.export_to_xml()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Now we a have a complete set of inputs, so we can go ahead and run our simulation." + ] + }, + { + "cell_type": "code", + "execution_count": 23, + "metadata": { + "collapsed": false, + "scrolled": true + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "\n", + " .d88888b. 888b d888 .d8888b.\n", + " d88P\" \"Y88b 8888b d8888 d88P Y88b\n", + " 888 888 88888b.d88888 888 888\n", + " 888 888 88888b. .d88b. 88888b. 888Y88888P888 888 \n", + " 888 888 888 \"88b d8P Y8b 888 \"88b 888 Y888P 888 888 \n", + " 888 888 888 888 88888888 888 888 888 Y8P 888 888 888\n", + " Y88b. .d88P 888 d88P Y8b. 888 888 888 \" 888 Y88b d88P\n", + " \"Y88888P\" 88888P\" \"Y8888 888 888 888 888 \"Y8888P\"\n", + "__________________888______________________________________________________\n", + " 888\n", + " 888\n", + "\n", + " Copyright: 2011-2015 Massachusetts Institute of Technology\n", + " License: http://mit-crpg.github.io/openmc/license.html\n", + " Version: 0.6.2\n", + " Date/Time: 2015-08-07 11:12:08\n", + " MPI Processes: 4\n", + "\n", + " ===========================================================================\n", + " ========================> INITIALIZATION <=========================\n", + " ===========================================================================\n", + "\n", + " Reading settings XML file...\n", + " Reading cross sections XML file...\n", + " Reading geometry XML file...\n", + " Reading materials XML file...\n", + " Reading tallies XML file...\n", + " Building neighboring cells lists for each surface...\n", + " Loading ACE cross section table: 92238.71c\n", + " Loading ACE cross section table: 8016.71c\n", + " Loading ACE cross section table: 92235.71c\n", + " Loading ACE cross section table: 5010.71c\n", + " Loading ACE cross section table: 1001.71c\n", + " Loading ACE cross section table: 40090.71c\n", + " Initializing source particles...\n", + "\n", + " ===========================================================================\n", + " ====================> K EIGENVALUE SIMULATION <====================\n", + " ===========================================================================\n", + "\n", + " Bat./Gen. k Average k \n", + " ========= ======== ==================== \n", + " 1/1 1.04944 \n", + " 2/1 1.03451 \n", + " 3/1 1.06490 \n", + " 4/1 1.04020 \n", + " 5/1 1.03270 \n", + " 6/1 1.09507 \n", + " 7/1 1.06827 1.08167 +/- 0.01340\n", + " 8/1 1.06089 1.07474 +/- 0.01038\n", + " 9/1 1.03806 1.06557 +/- 0.01175\n", + " 10/1 1.05032 1.06252 +/- 0.00960\n", + " 11/1 1.03259 1.05753 +/- 0.00929\n", + " 12/1 1.02588 1.05301 +/- 0.00906\n", + " 13/1 1.03872 1.05123 +/- 0.00805\n", + " 14/1 1.05396 1.05153 +/- 0.00710\n", + " 15/1 1.03818 1.05019 +/- 0.00649\n", + " 16/1 1.05015 1.05019 +/- 0.00587\n", + " 17/1 1.01418 1.04719 +/- 0.00614\n", + " 18/1 1.07342 1.04921 +/- 0.00600\n", + " 19/1 1.03023 1.04785 +/- 0.00572\n", + " 20/1 1.05405 1.04827 +/- 0.00534\n", + " Creating state point statepoint.20.h5...\n", + "\n", + " ===========================================================================\n", + " ======================> SIMULATION FINISHED <======================\n", + " ===========================================================================\n", + "\n", + "\n", + " =======================> TIMING STATISTICS <=======================\n", + "\n", + " Total time for initialization = 9.0500E-01 seconds\n", + " Reading cross sections = 2.6500E-01 seconds\n", + " Total time in simulation = 8.9630E+00 seconds\n", + " Time in transport only = 8.1580E+00 seconds\n", + " Time in inactive batches = 1.0700E+00 seconds\n", + " Time in active batches = 7.8930E+00 seconds\n", + " Time synchronizing fission bank = 7.6400E-01 seconds\n", + " Sampling source sites = 4.0000E-03 seconds\n", + " SEND/RECV source sites = 1.0000E-03 seconds\n", + " Time accumulating tallies = 1.0000E-03 seconds\n", + " Total time for finalization = 2.0000E-03 seconds\n", + " Total time elapsed = 9.8710E+00 seconds\n", + " Calculation Rate (inactive) = 11682.2 neutrons/second\n", + " Calculation Rate (active) = 4751.05 neutrons/second\n", + "\n", + " ============================> RESULTS <============================\n", + "\n", + " k-effective (Collision) = 1.04399 +/- 0.00515\n", + " k-effective (Track-length) = 1.04827 +/- 0.00534\n", + " k-effective (Absorption) = 1.03932 +/- 0.00588\n", + " Combined k-effective = 1.04364 +/- 0.00533\n", + " Leakage Fraction = 0.00000 +/- 0.00000\n", + "\n" + ] + }, + { + "data": { + "text/plain": [ + "0" + ] + }, + "execution_count": 23, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Remove old HDF5 (summary, statepoint) files\n", + "!rm statepoint.*\n", + "\n", + "# Run OpenMC with MPI!\n", + "executor.run_simulation(mpi_procs=4)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Tally Data Processing" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Our simulation ran successfully and created a statepoint file with all the tally data in it. We begin our analysis here loading the statepoint file and 'reading' the results. By default, the tally results are not read into memory because they might be large, even large enough to exceed the available memory on a computer." + ] + }, + { + "cell_type": "code", + "execution_count": 24, + "metadata": { + "collapsed": false, + "scrolled": true + }, + "outputs": [], + "source": [ + "# Load the statepoint file\n", + "sp = StatePoint('statepoint.20.h5')\n", + "sp.read_results()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "You may have also noticed we instructed OpenMC to create a summary file with lots of geometry information in it. This can help to produce more sensible output from the Python API, so we will use the summary file to link against." + ] + }, + { + "cell_type": "code", + "execution_count": 25, + "metadata": { + "collapsed": false, + "scrolled": true + }, + "outputs": [], + "source": [ + "# Load the summary file and link with statepoint\n", + "su = Summary('summary.h5')\n", + "sp.link_with_summary(su)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "We have a tally of the total fission rate and the total absorption rate, so we can calculating k-infinity as:\n", + "$$k_\\infty = \\frac{\\nu \\Sigma_f \\phi}{\\Sigma_a \\phi}$$" + ] + }, + { + "cell_type": "code", + "execution_count": 26, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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nuclidescoremeanstd. dev.
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0total(nu-fission / absorption)1.0420350.006584
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" + ], + "text/plain": [ + " nuclide score mean std. dev.\n", + "bin \n", + "0 total (nu-fission / absorption) 1.042035 0.006584" + ] + }, + "execution_count": 26, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Compute k-infinity using tally arithmetic\n", + "fiss_rate = sp.get_tally(name='fiss. rate')\n", + "abs_rate = sp.get_tally(name='abs. rate')\n", + "keff = fiss_rate / abs_rate\n", + "keff.get_pandas_dataframe()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Notice that even though the neutron production rate and absorption rate are separate tallies, we still get a first-order estimate of the uncertainty on the quotient of them automatically!\n", + "\n", + "Now, let's analyze of few of the classic factors in the four-factor formula, starting with the resonance escape probability, which we'll define as $$p=\\frac{\\Sigma_{a,thermal}\\phi}{\\Sigma_a\\phi}$$" + ] + }, + { + "cell_type": "code", + "execution_count": 27, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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nuclidescoremeanstd. dev.
bin
0totalabsorption0.9590670.00517
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" + ], + "text/plain": [ + " nuclide score mean std. dev.\n", + "bin \n", + "0 total absorption 0.959067 0.00517" + ] + }, + "execution_count": 27, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Compute resonance escape probability using tally arithmetic\n", + "therm_abs_rate = sp.get_tally(name='therm. abs. rate')\n", + "res_esc = therm_abs_rate / abs_rate\n", + "res_esc.get_pandas_dataframe()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "The fast fission factor can be calculated as\n", + "$$\\epsilon=\\frac{\\Sigma_f\\phi}{\\Sigma_{f,thermal}\\phi}$$" + ] + }, + { + "cell_type": "code", + "execution_count": 28, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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nuclidescoremeanstd. dev.
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0totalfission1.0801240.008126
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" + ], + "text/plain": [ + " nuclide score mean std. dev.\n", + "bin \n", + "0 total fission 1.080124 0.008126" + ] + }, + "execution_count": 28, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Compute fast fission factor factor using tally arithmetic\n", + "therm_fiss_rate = sp.get_tally(name='therm. fiss. rate')\n", + "tot_fiss_rate = sp.get_tally(name='tot. fiss. rate')\n", + "fast_fiss = tot_fiss_rate / therm_fiss_rate\n", + "fast_fiss.get_pandas_dataframe()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "The thermal flux utilization is calculated as\n", + "$$f=\\frac{\\Sigma_{a,thermal}^F\\phi}{\\Sigma_a\\phi}$$\n", + "where $F$ denotes fuel." + ] + }, + { + "cell_type": "code", + "execution_count": 29, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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nuclidescoremeanstd. dev.
bin
0totalabsorption0.7692630.004172
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" + ], + "text/plain": [ + " nuclide score mean std. dev.\n", + "bin \n", + "0 total absorption 0.769263 0.004172" + ] + }, + "execution_count": 29, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Compute thermal flux utilization factor using tally arithmetic\n", + "fuel_therm_abs_rate = sp.get_tally(name='fuel therm. abs. rate')\n", + "therm_util = fuel_therm_abs_rate / abs_rate\n", + "therm_util.get_pandas_dataframe()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Let's move on to a more complicated example now. Before we set up tallies to get reaction rates in the fuel and moderator in two energy groups for two different nuclides. We can use tally arithmetic to divide each of these reaction rates by the flux to get microscopic multi-group cross sections." + ] + }, + { + "cell_type": "code", + "execution_count": 30, + "metadata": { + "collapsed": false, + "scrolled": true + }, + "outputs": [], + "source": [ + "# Compute microscopic multi-group cross-sections\n", + "flux = sp.get_tally(name='flux')\n", + "flux = flux.get_slice(filters=['cell'], filter_bins=[(fuel_cell.id,)])\n", + "fuel_rxn_rates = sp.get_tally(name='fuel rxn rates')\n", + "mod_rxn_rates = sp.get_tally(name='moderator rxn rates')" + ] + }, + { + "cell_type": "code", + "execution_count": 31, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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cellenergy [MeV]nuclidescoremeanstd. dev.
bin
0100000.0e+00 - 6.3e-07(U-238 / total)(nu-fission / flux)0.0000015.999638e-09
1100000.0e+00 - 6.3e-07(U-238 / total)(scatter / flux)0.2099851.975043e-03
2100000.0e+00 - 6.3e-07(U-235 / total)(nu-fission / flux)0.3556003.196431e-03
3100000.0e+00 - 6.3e-07(U-235 / total)(scatter / flux)0.0055555.223274e-05
4100006.3e-07 - 2.0e+01(U-238 / total)(nu-fission / flux)0.0072007.935962e-05
5100006.3e-07 - 2.0e+01(U-238 / total)(scatter / flux)0.2275348.747338e-04
6100006.3e-07 - 2.0e+01(U-235 / total)(nu-fission / flux)0.0080904.645182e-05
7100006.3e-07 - 2.0e+01(U-235 / total)(scatter / flux)0.0033701.274353e-05
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" + ], + "text/plain": [ + " cell energy [MeV] nuclide score mean \\\n", + "bin \n", + "0 10000 0.0e+00 - 6.3e-07 (U-238 / total) (nu-fission / flux) 0.000001 \n", + "1 10000 0.0e+00 - 6.3e-07 (U-238 / total) (scatter / flux) 0.209985 \n", + "2 10000 0.0e+00 - 6.3e-07 (U-235 / total) (nu-fission / flux) 0.355600 \n", + "3 10000 0.0e+00 - 6.3e-07 (U-235 / total) (scatter / flux) 0.005555 \n", + "4 10000 6.3e-07 - 2.0e+01 (U-238 / total) (nu-fission / flux) 0.007200 \n", + "5 10000 6.3e-07 - 2.0e+01 (U-238 / total) (scatter / flux) 0.227534 \n", + "6 10000 6.3e-07 - 2.0e+01 (U-235 / total) (nu-fission / flux) 0.008090 \n", + "7 10000 6.3e-07 - 2.0e+01 (U-235 / total) (scatter / flux) 0.003370 \n", + "\n", + " std. dev. \n", + "bin \n", + "0 5.999638e-09 \n", + "1 1.975043e-03 \n", + "2 3.196431e-03 \n", + "3 5.223274e-05 \n", + "4 7.935962e-05 \n", + "5 8.747338e-04 \n", + "6 4.645182e-05 \n", + "7 1.274353e-05 " + ] + }, + "execution_count": 31, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "fuel_xs = fuel_rxn_rates / flux\n", + "fuel_xs.get_pandas_dataframe()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "We see that when the two tallies with multiple bins were divided, the derived tally contains the outer product of the combinations. If the filters/scores are the same, no outer product is needed. The `get_values(...)` method allows us to obtain a subset of tally scores. In the following example, we obtain just the neutron production microscopic cross sections." + ] + }, + { + "cell_type": "code", + "execution_count": 32, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "[[[ 6.64202005e-07]\n", + " [ 3.55599908e-01]]\n", + "\n", + " [[ 7.20046753e-03]\n", + " [ 8.09041760e-03]]]\n" + ] + } + ], + "source": [ + "# Show how to use Tally.get_values(...) with a CrossScore\n", + "nu_fiss_xs = fuel_xs.get_values(scores=['(nu-fission / flux)'])\n", + "print(nu_fiss_xs)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "The same idea can be used not only for scores but also for filters and nuclides." + ] + }, + { + "cell_type": "code", + "execution_count": 33, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "[[[ 0.00555494]]\n", + "\n", + " [[ 0.00337012]]]\n" + ] + } + ], + "source": [ + "# Show how to use Tally.get_values(...) with a CrossScore and CrossNuclide\n", + "u235_scatter_xs = fuel_xs.get_values(nuclides=['(U-235 / total)'], \n", + " scores=['(scatter / flux)'])\n", + "print(u235_scatter_xs)" + ] + }, + { + "cell_type": "code", + "execution_count": 34, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "[[[ 0.22753371]\n", + " [ 0.00337012]]]\n" + ] + } + ], + "source": [ + "# Show how to use Tally.get_values(...) with a CrossFilter and CrossScore\n", + "fast_scatter_xs = fuel_xs.get_values(filters=['energy'], \n", + " filter_bins=[((0.625e-6, 20.),)], \n", + " scores=['(scatter / flux)'])\n", + "print(fast_scatter_xs)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "A more advanced method is to use `get_slice(...)` to create a new derived tally that is a subset of an existing tally. This has the benefit that we can use `get_pandas_dataframe()` to see the tallies in a more human-readable format." + ] + }, + { + "cell_type": "code", + "execution_count": 35, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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cellenergy [MeV]nuclidescoremeanstd. dev.
bin
0100000.0e+00 - 6.3e-07U-238nu-fission0.0000029.952309e-09
1100000.0e+00 - 6.3e-07U-235nu-fission0.8719945.271360e-03
2100006.3e-07 - 2.0e+01U-238nu-fission0.0830068.813292e-04
3100006.3e-07 - 2.0e+01U-235nu-fission0.0932654.590785e-04
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" + ], + "text/plain": [ + " cell energy [MeV] nuclide score mean std. dev.\n", + "bin \n", + "0 10000 0.0e+00 - 6.3e-07 U-238 nu-fission 0.000002 9.952309e-09\n", + "1 10000 0.0e+00 - 6.3e-07 U-235 nu-fission 0.871994 5.271360e-03\n", + "2 10000 6.3e-07 - 2.0e+01 U-238 nu-fission 0.083006 8.813292e-04\n", + "3 10000 6.3e-07 - 2.0e+01 U-235 nu-fission 0.093265 4.590785e-04" + ] + }, + "execution_count": 35, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# \"Slice\" the nu-fission data into a new derived Tally\n", + "nu_fission_rates = fuel_rxn_rates.get_slice(scores=['nu-fission'])\n", + "nu_fission_rates.get_pandas_dataframe()" + ] + }, + { + "cell_type": "code", + "execution_count": 36, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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cellenergy [MeV]nuclidescoremeanstd. dev.
bin
0100021.0e-08 - 1.1e-07H-1scatter4.6695350.032937
1100021.1e-07 - 1.2e-06H-1scatter2.0347860.014311
2100021.2e-06 - 1.3e-05H-1scatter1.6644400.014963
3100021.3e-05 - 1.4e-04H-1scatter1.8754060.011341
4100021.4e-04 - 1.5e-03H-1scatter2.0650550.013958
5100021.5e-03 - 1.6e-02H-1scatter2.1444620.011313
6100021.6e-02 - 1.7e-01H-1scatter2.2065290.011302
7100021.7e-01 - 1.9e+00H-1scatter1.9923360.012023
8100021.9e+00 - 2.0e+01H-1scatter0.3774000.004341
\n", + "
" + ], + "text/plain": [ + " cell energy [MeV] nuclide score mean std. dev.\n", + "bin \n", + "0 10002 1.0e-08 - 1.1e-07 H-1 scatter 4.669535 0.032937\n", + "1 10002 1.1e-07 - 1.2e-06 H-1 scatter 2.034786 0.014311\n", + "2 10002 1.2e-06 - 1.3e-05 H-1 scatter 1.664440 0.014963\n", + "3 10002 1.3e-05 - 1.4e-04 H-1 scatter 1.875406 0.011341\n", + "4 10002 1.4e-04 - 1.5e-03 H-1 scatter 2.065055 0.013958\n", + "5 10002 1.5e-03 - 1.6e-02 H-1 scatter 2.144462 0.011313\n", + "6 10002 1.6e-02 - 1.7e-01 H-1 scatter 2.206529 0.011302\n", + "7 10002 1.7e-01 - 1.9e+00 H-1 scatter 1.992336 0.012023\n", + "8 10002 1.9e+00 - 2.0e+01 H-1 scatter 0.377400 0.004341" + ] + }, + "execution_count": 36, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# \"Slice\" the H-1 scatter data in the moderator Cell into a new derived Tally\n", + "need_to_slice = sp.get_tally(name='need-to-slice')\n", + "slice_test = need_to_slice.get_slice(scores=['scatter'], nuclides=['H-1'],\n", + " filters=['cell'], filter_bins=[(moderator_cell.id,)])\n", + "slice_test.get_pandas_dataframe()" + ] + } + ], + "metadata": { + "kernelspec": { + "display_name": "Python 2", + "language": "python", + "name": "python2" + }, + "language_info": { + "codemirror_mode": { + "name": "ipython", + "version": 2 + }, + "file_extension": ".py", + "mimetype": "text/x-python", + "name": "python", + "nbconvert_exporter": "python", + "pygments_lexer": "ipython2", + "version": "2.7.8" + } + }, + "nbformat": 4, + "nbformat_minor": 0 +} diff --git a/docs/source/pythonapi/examples/tally-arithmetic.rst b/docs/source/pythonapi/examples/tally-arithmetic.rst new file mode 100644 index 000000000..5f3cf775e --- /dev/null +++ b/docs/source/pythonapi/examples/tally-arithmetic.rst @@ -0,0 +1,11 @@ +================ +Tally Arithmetic +================ + +.. only:: html + + .. notebook:: tally-arithmetic.ipynb + +.. only:: latex + + IPython notebooks must be viewed in the online HTML documentation. diff --git a/docs/source/pythonapi/index.rst b/docs/source/pythonapi/index.rst index f6c26557d..38314f4ea 100644 --- a/docs/source/pythonapi/index.rst +++ b/docs/source/pythonapi/index.rst @@ -4,9 +4,7 @@ Python API ========== --------- -Contents --------- +**API Documentation:** .. toctree:: :maxdepth: 1 @@ -30,3 +28,10 @@ Contents tallies trigger universe + +**Examples:** + +.. toctree:: + :maxdepth: 1 + + examples/tally-arithmetic diff --git a/docs/sphinxext/LICENSE b/docs/sphinxext/LICENSE new file mode 100644 index 000000000..2d508d2be --- /dev/null +++ b/docs/sphinxext/LICENSE @@ -0,0 +1,68 @@ +The file notebook_sphinxext.py was derived from code in PyNE and yt. + +PyNE has the following license: + +------------------------------------------------------------------------------- +Copyright 2011-2015, the PyNE Development Team. All rights reserved. + +Redistribution and use in source and binary forms, with or without modification, are +permitted provided that the following conditions are met: + + 1. Redistributions of source code must retain the above copyright notice, this list of + conditions and the following disclaimer. + + 2. Redistributions in binary form must reproduce the above copyright notice, this list + of conditions and the following disclaimer in the documentation and/or other materials + provided with the distribution. + +THIS SOFTWARE IS PROVIDED BY THE PYNE DEVELOPMENT TEAM ``AS IS'' AND ANY EXPRESS OR IMPLIED +WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE IMPLIED WARRANTIES OF MERCHANTABILITY AND +FITNESS FOR A PARTICULAR PURPOSE ARE DISCLAIMED. IN NO EVENT SHALL OR +CONTRIBUTORS BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR +CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS OR +SERVICES; LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON +ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT (INCLUDING +NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS SOFTWARE, EVEN IF +ADVISED OF THE POSSIBILITY OF SUCH DAMAGE. + +The views and conclusions contained in the software and documentation are those of the +authors and should not be interpreted as representing official policies, either expressed +or implied, of the stakeholders of the PyNE project or the employers of PyNE developers. +------------------------------------------------------------------------------- + +yt has the following license: + +------------------------------------------------------------------------------- +yt is licensed under the terms of the Modified BSD License (also known as New +or Revised BSD), as follows: + +Copyright (c) 2013-, yt Development Team +Copyright (c) 2006-2013, Matthew Turk + +All rights reserved. + +Redistribution and use in source and binary forms, with or without +modification, are permitted provided that the following conditions are met: + +Redistributions of source code must retain the above copyright notice, this +list of conditions and the following disclaimer. + +Redistributions in binary form must reproduce the above copyright notice, this +list of conditions and the following disclaimer in the documentation and/or +other materials provided with the distribution. + +Neither the name of the yt Development Team nor the names of its +contributors may be used to endorse or promote products derived from this +software without specific prior written permission. + +THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS" AND +ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE IMPLIED +WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE ARE +DISCLAIMED. IN NO EVENT SHALL THE COPYRIGHT OWNER OR CONTRIBUTORS BE LIABLE +FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL +DAMAGES (INCLUDING, BUT NOT LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS OR +SERVICES; LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER +CAUSED AND ON ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, +OR TORT (INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE +OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE. +------------------------------------------------------------------------------- diff --git a/docs/sphinxext/notebook_sphinxext.py b/docs/sphinxext/notebook_sphinxext.py new file mode 100644 index 000000000..a9d634a35 --- /dev/null +++ b/docs/sphinxext/notebook_sphinxext.py @@ -0,0 +1,120 @@ +import sys +import os.path +import re +import time +from docutils import io, nodes, statemachine, utils +try: + from docutils.utils.error_reporting import ErrorString # the new way +except ImportError: + from docutils.error_reporting import ErrorString # the old way +from docutils.parsers.rst import Directive, convert_directive_function +from docutils.parsers.rst import directives, roles, states +from docutils.parsers.rst.roles import set_classes +from docutils.transforms import misc + +try: + from IPython.nbconver.exporters import html +except ImportError: + from IPython.nbconvert import html + + +class Notebook(Directive): + """Use nbconvert to insert a notebook into the environment. + This is based on the Raw directive in docutils + """ + required_arguments = 1 + optional_arguments = 0 + final_argument_whitespace = True + option_spec = {} + has_content = False + + def run(self): + # check if raw html is supported + if not self.state.document.settings.raw_enabled: + raise self.warning('"%s" directive disabled.' % self.name) + + # set up encoding + attributes = {'format': 'html'} + encoding = self.options.get( + 'encoding', self.state.document.settings.input_encoding) + e_handler = self.state.document.settings.input_encoding_error_handler + + # get path to notebook + source_dir = os.path.dirname( + os.path.abspath(self.state.document.current_source)) + nb_path = os.path.normpath(os.path.join(source_dir, + self.arguments[0])) + nb_path = utils.relative_path(None, nb_path) + + # convert notebook to html + exporter = html.HTMLExporter(template_file='full') + output, resources = exporter.from_filename(nb_path) + header = output.split('', 1)[1].split('',1)[0] + body = output.split('', 1)[1].split('',1)[0] + + # add HTML5 scoped attribute to header style tags + header = header.replace(''] + lines.append(header) + lines.append(body) + lines.append('') + text = '\n'.join(lines) + + # add dependency + self.state.document.settings.record_dependencies.add(nb_path) + attributes['source'] = nb_path + + # create notebook node + nb_node = notebook('', text, **attributes) + (nb_node.source, nb_node.line) = \ + self.state_machine.get_source_and_line(self.lineno) + + return [nb_node] + + +class notebook(nodes.raw): + pass + + +def visit_notebook_node(self, node): + self.visit_raw(node) + + +def depart_notebook_node(self, node): + self.depart_raw(node) + + +def setup(app): + app.add_node(notebook, + html=(visit_notebook_node, depart_notebook_node)) + + app.add_directive('notebook', Notebook) From 043bb1b1f689d697201ec4d0c3c0992c105c41c5 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Fri, 7 Aug 2015 12:01:38 +0700 Subject: [PATCH 02/43] Better organization of top-level Python API page --- docs/source/pythonapi/index.rst | 34 ++++++++++++++++++++++++++++----- 1 file changed, 29 insertions(+), 5 deletions(-) diff --git a/docs/source/pythonapi/index.rst b/docs/source/pythonapi/index.rst index 38314f4ea..253362597 100644 --- a/docs/source/pythonapi/index.rst +++ b/docs/source/pythonapi/index.rst @@ -4,31 +4,55 @@ Python API ========== -**API Documentation:** +OpenMC includes a rich Python API that enables programmatic pre- and +post-processing. The easiest way to begin using the API is to take a look at the +example IPython notebooks provided. The full API documentation serves to provide +more information on a given module or class. + +**Handling nuclear data:** .. toctree:: :maxdepth: 1 ace + +**Creating input files:** + +.. toctree:: + :maxdepth: 1 + cmfd element - executor filter geometry material mesh nuclide opencg_compatible - particle_restart plots settings - statepoint - summary surface tallies trigger universe +**Running OpenMC:** + +.. toctree:: + :maxdepth: 1 + + executor + +**Post-processing:** + +.. toctree:: + :maxdepth: 1 + + particle_restart + statepoint + summary + tallies + **Examples:** .. toctree:: From 56b0cbb1e721b8edb708dd216d6f896eb63d7129 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Sat, 8 Aug 2015 09:51:29 +0700 Subject: [PATCH 03/43] Add Jupyter notebook showing use of Pandas dataframes --- .gitignore | 3 + .../examples/pandas-dataframes.ipynb | 2482 +++++++++++++++++ .../pythonapi/examples/pandas-dataframes.rst | 11 + docs/source/pythonapi/index.rst | 5 +- 4 files changed, 2499 insertions(+), 2 deletions(-) create mode 100644 docs/source/pythonapi/examples/pandas-dataframes.ipynb create mode 100644 docs/source/pythonapi/examples/pandas-dataframes.rst diff --git a/.gitignore b/.gitignore index bfa33d856..5634632fa 100644 --- a/.gitignore +++ b/.gitignore @@ -60,3 +60,6 @@ data/nndc # PyCharm project configuration files .idea .idea/* + +# IPython notebook checkpoints +.ipynb_checkpoints \ No newline at end of file diff --git a/docs/source/pythonapi/examples/pandas-dataframes.ipynb b/docs/source/pythonapi/examples/pandas-dataframes.ipynb new file mode 100644 index 000000000..485420565 --- /dev/null +++ b/docs/source/pythonapi/examples/pandas-dataframes.ipynb @@ -0,0 +1,2482 @@ +{ + "cells": [ + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "This notebook demonstrates how systematic analysis of tally scores is possible using Pandas dataframes. A dataframe can be automatically generated using the `Tally.get_pandas_dataframe(...)` method. Furthermore, by linking the tally data in a statepoint file with geometry and material information from a summary file, the dataframe can be shown with user-supplied labels.\n", + "\n", + "**Note:** that this Notebook was created using the latest Pandas v0.16.1. Everything in the Notebook will wun with older versions of Pandas, but the multi-indexing option in >v0.15.0 makes the tables look prettier." + ] + }, + { + "cell_type": "code", + "execution_count": 1, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "import glob\n", + "from IPython.display import Image\n", + "import matplotlib.pylab as pylab\n", + "import scipy.stats\n", + "import numpy as np\n", + "\n", + "import openmc\n", + "from openmc.statepoint import StatePoint\n", + "from openmc.summary import Summary\n", + "\n", + "%matplotlib inline" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Generate Input Files" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "First we need to define materials that will be used in the problem. Before defining a material, we must create nuclides that are used in the material." + ] + }, + { + "cell_type": "code", + "execution_count": 2, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# Instantiate some Nuclides\n", + "h1 = openmc.Nuclide('H-1')\n", + "b10 = openmc.Nuclide('B-10')\n", + "o16 = openmc.Nuclide('O-16')\n", + "u235 = openmc.Nuclide('U-235')\n", + "u238 = openmc.Nuclide('U-238')\n", + "zr90 = openmc.Nuclide('Zr-90')" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "With the nuclides we defined, we will now create three materials for the fuel, water, and cladding of the fuel pin." + ] + }, + { + "cell_type": "code", + "execution_count": 3, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# 1.6 enriched fuel\n", + "fuel = openmc.Material(name='1.6% Fuel')\n", + "fuel.set_density('g/cm3', 10.31341)\n", + "fuel.add_nuclide(u235, 3.7503e-4)\n", + "fuel.add_nuclide(u238, 2.2625e-2)\n", + "fuel.add_nuclide(o16, 4.6007e-2)\n", + "\n", + "# borated water\n", + "water = openmc.Material(name='Borated Water')\n", + "water.set_density('g/cm3', 0.740582)\n", + "water.add_nuclide(h1, 4.9457e-2)\n", + "water.add_nuclide(o16, 2.4732e-2)\n", + "water.add_nuclide(b10, 8.0042e-6)\n", + "\n", + "# zircaloy\n", + "zircaloy = openmc.Material(name='Zircaloy')\n", + "zircaloy.set_density('g/cm3', 6.55)\n", + "zircaloy.add_nuclide(zr90, 7.2758e-3)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "With our three materials, we can now create a materials file object that can be exported to an actual XML file." + ] + }, + { + "cell_type": "code", + "execution_count": 4, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Instantiate a MaterialsFile, add Materials\n", + "materials_file = openmc.MaterialsFile()\n", + "materials_file.add_material(fuel)\n", + "materials_file.add_material(water)\n", + "materials_file.add_material(zircaloy)\n", + "materials_file.default_xs = '71c'\n", + "\n", + "# Export to \"materials.xml\"\n", + "materials_file.export_to_xml()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Now let's move on to the geometry. This problem will be a square array of fuel pins, which we can use OpenMC's lattice/universe feature for. The basic universe will have three regions for the fuel, the clad, and the surrounding coolant. The first step is to create the bounding surfaces for fuel and clad, as well as the outer bounding surfaces of the problem." + ] + }, + { + "cell_type": "code", + "execution_count": 5, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Create cylinders for the fuel and clad\n", + "fuel_outer_radius = openmc.ZCylinder(x0=0.0, y0=0.0, R=0.39218)\n", + "clad_outer_radius = openmc.ZCylinder(x0=0.0, y0=0.0, R=0.45720)\n", + "\n", + "# Create boundary planes to surround the geometry\n", + "# Use both reflective and vacuum boundaries to make life interesting\n", + "min_x = openmc.XPlane(x0=-10.71, boundary_type='reflective')\n", + "max_x = openmc.XPlane(x0=+10.71, boundary_type='vacuum')\n", + "min_y = openmc.YPlane(y0=-10.71, boundary_type='vacuum')\n", + "max_y = openmc.YPlane(y0=+10.71, boundary_type='reflective')\n", + "min_z = openmc.ZPlane(z0=-10.71, boundary_type='reflective')\n", + "max_z = openmc.ZPlane(z0=+10.71, boundary_type='reflective')" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "With the surfaces defined, we can now create cells that are defined by intersections of half-spaces created by the surfaces." + ] + }, + { + "cell_type": "code", + "execution_count": 6, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Create a Universe to encapsulate a fuel pin\n", + "pin_cell_universe = openmc.Universe(name='1.6% Fuel Pin')\n", + "\n", + "# Create fuel Cell\n", + "fuel_cell = openmc.Cell(name='1.6% Fuel')\n", + "fuel_cell.fill = fuel\n", + "fuel_cell.add_surface(fuel_outer_radius, halfspace=-1)\n", + "pin_cell_universe.add_cell(fuel_cell)\n", + "\n", + "# Create a clad Cell\n", + "clad_cell = openmc.Cell(name='1.6% Clad')\n", + "clad_cell.fill = zircaloy\n", + "clad_cell.add_surface(fuel_outer_radius, halfspace=+1)\n", + "clad_cell.add_surface(clad_outer_radius, halfspace=-1)\n", + "pin_cell_universe.add_cell(clad_cell)\n", + "\n", + "# Create a moderator Cell\n", + "moderator_cell = openmc.Cell(name='1.6% Moderator')\n", + "moderator_cell.fill = water\n", + "moderator_cell.add_surface(clad_outer_radius, halfspace=+1)\n", + "pin_cell_universe.add_cell(moderator_cell)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Using the pin cell universe, we can construct a 17x17 rectangular lattice with a 1.26cm pitch." + ] + }, + { + "cell_type": "code", + "execution_count": 7, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Create fuel assembly Lattice\n", + "assembly = openmc.RectLattice(name='1.6% Fuel - 0BA')\n", + "assembly.dimension = (17, 17)\n", + "assembly.pitch = (1.26, 1.26)\n", + "assembly.lower_left = [-1.26 * 17. / 2.0] * 2\n", + "assembly.universes = [[pin_cell_universe] * 17] * 17" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "OpenMC requires that there is a \"root\" universe. Let us create a root cell that is filled by the pin cell universe and then assign it to the root universe." + ] + }, + { + "cell_type": "code", + "execution_count": 8, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Create root Cell\n", + "root_cell = openmc.Cell(name='root cell')\n", + "root_cell.fill = assembly\n", + "\n", + "# Add boundary planes\n", + "root_cell.add_surface(min_x, halfspace=+1)\n", + "root_cell.add_surface(max_x, halfspace=-1)\n", + "root_cell.add_surface(min_y, halfspace=+1)\n", + "root_cell.add_surface(max_y, halfspace=-1)\n", + "root_cell.add_surface(min_z, halfspace=+1)\n", + "root_cell.add_surface(max_z, halfspace=-1)\n", + "\n", + "# Create root Universe\n", + "root_universe = openmc.Universe(universe_id=0, name='root universe')\n", + "root_universe.add_cell(root_cell)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "We now must create a geometry that is assigned a root universe, put the geometry into a geometry file, and export it to XML." + ] + }, + { + "cell_type": "code", + "execution_count": 9, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# Create Geometry and set root Universe\n", + "geometry = openmc.Geometry()\n", + "geometry.root_universe = root_universe" + ] + }, + { + "cell_type": "code", + "execution_count": 10, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Instantiate a GeometryFile\n", + "geometry_file = openmc.GeometryFile()\n", + "geometry_file.geometry = geometry\n", + "\n", + "# Export to \"geometry.xml\"\n", + "geometry_file.export_to_xml()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "With the geometry and materials finished, we now just need to define simulation parameters. In this case, we will use 5 inactive batches and 15 minimum active batches each with 2500 particles. We also tell OpenMC to turn tally triggers on, which means it will keep running until some criterion on the uncertainty of tallies is reached." + ] + }, + { + "cell_type": "code", + "execution_count": 11, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# OpenMC simulation parameters\n", + "min_batches = 20\n", + "max_batches = 200\n", + "inactive = 5\n", + "particles = 2500\n", + "\n", + "# Instantiate a SettingsFile\n", + "settings_file = openmc.SettingsFile()\n", + "settings_file.batches = min_batches\n", + "settings_file.inactive = inactive\n", + "settings_file.particles = particles\n", + "settings_file.output = {'tallies': False, 'summary': True}\n", + "settings_file.trigger_active = True\n", + "settings_file.trigger_max_batches = max_batches\n", + "source_bounds = [-10.71, -10.71, -10, 10.71, 10.71, 10.]\n", + "settings_file.set_source_space('box', source_bounds)\n", + "\n", + "# Export to \"settings.xml\"\n", + "settings_file.export_to_xml()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Let us also create a plot file that we can use to verify that our pin cell geometry was created successfully." + ] + }, + { + "cell_type": "code", + "execution_count": 12, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Instantiate a Plot\n", + "plot = openmc.Plot(plot_id=1)\n", + "plot.filename = 'materials-xy'\n", + "plot.origin = [0, 0, 0]\n", + "plot.width = [21.5, 21.5]\n", + "plot.pixels = [250, 250]\n", + "plot.color = 'mat'\n", + "\n", + "# Instantiate a PlotsFile, add Plot, and export to \"plots.xml\"\n", + "plot_file = openmc.PlotsFile()\n", + "plot_file.add_plot(plot)\n", + "plot_file.export_to_xml()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "With the plots.xml file, we can now generate and view the plot. OpenMC outputs plots in .ppm format, which can be converted into a compressed format like .png with the convert utility." + ] + }, + { + "cell_type": "code", + "execution_count": 13, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "image/png": "iVBORw0KGgoAAAANSUhEUgAAAPoAAAD6AgMAAAD1grKuAAAABGdBTUEAALGPC/xhBQAAAAFzUkdC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\nMMhPICoAAAAASUVORK5CYII=\n", + "text/plain": [ + "" + ] + }, + "execution_count": 13, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Run openmc in plotting mode\n", + "executor = openmc.Executor()\n", + "executor.plot_geometry(output=False)\n", + "\n", + "# Convert OpenMC's funky ppm to png\n", + "!convert materials-xy.ppm materials-xy.png\n", + "\n", + "# Display the materials plot inline\n", + "Image(filename='materials-xy.png')" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "As we can see from the plot, we have a nice array of pin cells with fuel, cladding, and water! Before we run our simulation, we need to tell the code what we want to tally. The following code shows how to create a variety of tallies." + ] + }, + { + "cell_type": "code", + "execution_count": 14, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# Instantiate an empty TalliesFile\n", + "tallies_file = openmc.TalliesFile()\n", + "tallies_file._tallies = []" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Instantiate a fission rate mesh Tally" + ] + }, + { + "cell_type": "code", + "execution_count": 15, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Instantiate a tally Mesh\n", + "mesh = openmc.Mesh(mesh_id=1)\n", + "mesh.type = 'rectangular'\n", + "mesh.dimension = [17, 17]\n", + "mesh.lower_left = [-10.71, -10.71]\n", + "mesh.width = [1.26, 1.26]\n", + "\n", + "# Instantiate tally Filter\n", + "mesh_filter = openmc.Filter()\n", + "mesh_filter.mesh = mesh\n", + "\n", + "# Instantiate energy Filter\n", + "energy_filter = openmc.Filter()\n", + "energy_filter.type = 'energy'\n", + "energy_filter.bins = np.array([0, 0.625e-6, 20.])\n", + "\n", + "# Instantiate the Tally\n", + "tally = openmc.Tally(name='mesh tally')\n", + "tally.add_filter(mesh_filter)\n", + "tally.add_filter(energy_filter)\n", + "tally.add_score('fission')\n", + "tally.add_score('nu-fission')\n", + "\n", + "# Add mesh and Tally to TalliesFile\n", + "tallies_file.add_mesh(mesh)\n", + "tallies_file.add_tally(tally)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Instantiate a cell Tally with nuclides" + ] + }, + { + "cell_type": "code", + "execution_count": 16, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# Instantiate tally Filter\n", + "cell_filter = openmc.Filter(type='cell', bins=[fuel_cell.id])\n", + "\n", + "# Instantiate the tally\n", + "tally = openmc.Tally(name='cell tally')\n", + "tally.add_filter(cell_filter)\n", + "tally.add_score('scatter-y2')\n", + "tally.add_nuclide(u235)\n", + "tally.add_nuclide(u238)\n", + "\n", + "# Add mesh and tally to TalliesFile\n", + "tallies_file.add_tally(tally)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Create a \"distribcell\" Tally. The distribcell filter allows us to tally multiple repeated instances of the same cell throughout the geometry." + ] + }, + { + "cell_type": "code", + "execution_count": 17, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# Instantiate tally Filter\n", + "distribcell_filter = openmc.Filter(type='distribcell', bins=[moderator_cell.id])\n", + "\n", + "# Instantiate tally Trigger for kicks\n", + "trigger = openmc.Trigger(trigger_type='std_dev', threshold=5e-5)\n", + "trigger.add_score('absorption')\n", + "\n", + "# Instantiate the Tally\n", + "tally = openmc.Tally(name='distribcell tally')\n", + "tally.add_filter(distribcell_filter)\n", + "tally.add_score('absorption')\n", + "tally.add_score('scatter')\n", + "tally.add_trigger(trigger)\n", + "\n", + "# Add mesh and tally to TalliesFile\n", + "tallies_file.add_tally(tally)" + ] + }, + { + "cell_type": "code", + "execution_count": 18, + "metadata": { + "collapsed": true + }, + "outputs": [], + "source": [ + "# Export to \"tallies.xml\"\n", + "tallies_file.export_to_xml()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Now we a have a complete set of inputs, so we can go ahead and run our simulation." + ] + }, + { + "cell_type": "code", + "execution_count": 19, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "\n", + " .d88888b. 888b d888 .d8888b.\n", + " d88P\" \"Y88b 8888b d8888 d88P Y88b\n", + " 888 888 88888b.d88888 888 888\n", + " 888 888 88888b. .d88b. 88888b. 888Y88888P888 888 \n", + " 888 888 888 \"88b d8P Y8b 888 \"88b 888 Y888P 888 888 \n", + " 888 888 888 888 88888888 888 888 888 Y8P 888 888 888\n", + " Y88b. .d88P 888 d88P Y8b. 888 888 888 \" 888 Y88b d88P\n", + " \"Y88888P\" 88888P\" \"Y8888 888 888 888 888 \"Y8888P\"\n", + "__________________888______________________________________________________\n", + " 888\n", + " 888\n", + "\n", + " Copyright: 2011-2015 Massachusetts Institute of Technology\n", + " License: http://mit-crpg.github.io/openmc/license.html\n", + " Version: 0.6.2\n", + " Date/Time: 2015-08-08 09:29:37\n", + " MPI Processes: 4\n", + "\n", + " ===========================================================================\n", + " ========================> INITIALIZATION <=========================\n", + " ===========================================================================\n", + "\n", + " Reading settings XML file...\n", + " Reading cross sections XML file...\n", + " Reading geometry XML file...\n", + " Reading materials XML file...\n", + " Reading tallies XML file...\n", + " Building neighboring cells lists for each surface...\n", + " Loading ACE cross section table: 92238.71c\n", + " Loading ACE cross section table: 8016.71c\n", + " Loading ACE cross section table: 92235.71c\n", + " Loading ACE cross section table: 5010.71c\n", + " Loading ACE cross section table: 1001.71c\n", + " Loading ACE cross section table: 40090.71c\n", + " Initializing source particles...\n", + "\n", + " ===========================================================================\n", + " ====================> K EIGENVALUE SIMULATION <====================\n", + " ===========================================================================\n", + "\n", + " Bat./Gen. k Average k \n", + " ========= ======== ==================== \n", + " 1/1 0.60069 \n", + " 2/1 0.62857 \n", + " 3/1 0.69431 \n", + " 4/1 0.65935 \n", + " 5/1 0.68092 \n", + " 6/1 0.64791 \n", + " 7/1 0.65859 0.65325 +/- 0.00534\n", + " 8/1 0.67381 0.66010 +/- 0.00752\n", + " 9/1 0.74149 0.68045 +/- 0.02103\n", + " 10/1 0.68244 0.68085 +/- 0.01629\n", + " 11/1 0.68068 0.68082 +/- 0.01330\n", + " 12/1 0.70394 0.68412 +/- 0.01172\n", + " 13/1 0.68624 0.68439 +/- 0.01015\n", + " 14/1 0.65667 0.68131 +/- 0.00947\n", + " 15/1 0.70080 0.68326 +/- 0.00869\n", + " 16/1 0.69639 0.68445 +/- 0.00795\n", + " 17/1 0.68786 0.68474 +/- 0.00726\n", + " 18/1 0.63698 0.68106 +/- 0.00762\n", + " 19/1 0.62785 0.67726 +/- 0.00802\n", + " 20/1 0.65759 0.67595 +/- 0.00758\n", + " Triggers unsatisfied, max unc./thresh. is 1.20713 for absorption in tally 10002\n", + " The estimated number of batches is 27\n", + " Creating state point statepoint.020.h5...\n", + " 21/1 0.68391 0.67645 +/- 0.00711\n", + " 22/1 0.69243 0.67739 +/- 0.00674\n", + " 23/1 0.65491 0.67614 +/- 0.00648\n", + " 24/1 0.64021 0.67425 +/- 0.00641\n", + " 25/1 0.72281 0.67668 +/- 0.00655\n", + " 26/1 0.71261 0.67839 +/- 0.00646\n", + " 27/1 0.69503 0.67914 +/- 0.00621\n", + " Triggers satisfied for batch 27\n", + " Creating state point statepoint.027.h5...\n", + "\n", + " ===========================================================================\n", + " ======================> SIMULATION FINISHED <======================\n", + " ===========================================================================\n", + "\n", + "\n", + " =======================> TIMING STATISTICS <=======================\n", + "\n", + " Total time for initialization = 9.4600E-01 seconds\n", + " Reading cross sections = 2.8400E-01 seconds\n", + " Total time in simulation = 5.9780E+00 seconds\n", + " Time in transport only = 5.6820E+00 seconds\n", + " Time in inactive batches = 7.8500E-01 seconds\n", + " Time in active batches = 5.1930E+00 seconds\n", + " Time synchronizing fission bank = 2.3000E-01 seconds\n", + " Sampling source sites = 1.0000E-03 seconds\n", + " SEND/RECV source sites = 2.0000E-03 seconds\n", + " Time accumulating tallies = 2.0000E-03 seconds\n", + " Total time for finalization = 1.0000E-03 seconds\n", + " Total time elapsed = 6.9280E+00 seconds\n", + " Calculation Rate (inactive) = 15923.6 neutrons/second\n", + " Calculation Rate (active) = 7221.26 neutrons/second\n", + "\n", + " ============================> RESULTS <============================\n", + "\n", + " k-effective (Collision) = 0.68117 +/- 0.00597\n", + " k-effective (Track-length) = 0.67914 +/- 0.00621\n", + " k-effective (Absorption) = 0.67898 +/- 0.00471\n", + " Combined k-effective = 0.67922 +/- 0.00479\n", + " Leakage Fraction = 0.34264 +/- 0.00301\n", + "\n" + ] + }, + { + "data": { + "text/plain": [ + "0" + ] + }, + "execution_count": 19, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Remove old HDF5 (summary, statepoint) files\n", + "!rm statepoint.*\n", + "\n", + "# Run OpenMC with MPI!\n", + "executor.run_simulation(mpi_procs=4)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "## Tally Data Processing" + ] + }, + { + "cell_type": "code", + "execution_count": 20, + "metadata": { + "collapsed": false + }, + "outputs": [], + "source": [ + "# We do not know how many batches were needed to satisfy the \n", + "# tally trigger(s), so find the statepoint file(s)\n", + "statepoints = glob.glob('statepoint.*.h5')\n", + "\n", + "# Load the last statepoint file\n", + "sp = StatePoint(statepoints[-1])\n", + "sp.read_results()\n", + "sp.compute_stdev()" + ] + }, + { + "cell_type": "code", + "execution_count": 21, + "metadata": { + "collapsed": false, + "scrolled": true + }, + "outputs": [], + "source": [ + "# Load the summary file and link with statepoint\n", + "su = Summary('summary.h5')\n", + "sp.link_with_summary(su)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "**Analyze the mesh fission rate tally**" + ] + }, + { + "cell_type": "code", + "execution_count": 22, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "Tally\n", + "\tID =\t10000\n", + "\tName =\tmesh tally\n", + "\tFilters =\t\n", + " \t\tmesh\t[1]\n", + " \t\tenergy\t[ 0.00000000e+00 6.25000000e-07 2.00000000e+01]\n", + "\tNuclides =\ttotal \n", + "\tScores =\t['fission', 'nu-fission']\n", + "\tEstimator =\ttracklength\n", + "\n" + ] + } + ], + "source": [ + "# Find the mesh tally with the StatePoint API\n", + "tally = sp.get_tally(name='mesh tally')\n", + "\n", + "# Print a little info about the mesh tally to the screen\n", + "print(tally)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Use the new Tally data retrieval API with pure NumPy" + ] + }, + { + "cell_type": "code", + "execution_count": 23, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "[[[ 0.14583021]]\n", + "\n", + " [[ 0.07919847]]\n", + "\n", + " [[ 0.22707514]]\n", + "\n", + " [[ 0.07537836]]\n", + "\n", + " [[ 0.07919847]]\n", + "\n", + " [[ 0.07846909]]\n", + "\n", + " [[ 0.07537836]]\n", + "\n", + " [[ 0.07177901]]\n", + "\n", + " [[ 0.22707514]]\n", + "\n", + " [[ 0.07537836]]\n", + "\n", + " [[ 0.33705448]]\n", + "\n", + " [[ 0.177405 ]]\n", + "\n", + " [[ 0.07537836]]\n", + "\n", + " [[ 0.07177901]]\n", + "\n", + " [[ 0.177405 ]]\n", + "\n", + " [[ 0.15150059]]]\n" + ] + } + ], + "source": [ + "# Get the relative error for the thermal fission reaction \n", + "# rates in the four corner pins \n", + "data = tally.get_values(scores=['fission'], filters=['mesh', 'energy'], \\\n", + " filter_bins=[((1,1),(1,17), (17,1), (17,17)), \\\n", + " ((0., 0.625e-6),)], value='rel_err')\n", + "print(data)" + ] + }, + { + "cell_type": "code", + "execution_count": 24, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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mesh 1energy [MeV]scoremeanstd. dev.
xyz
bin
01110.0e+00 - 6.3e-07fission0.0002360.000034
11110.0e+00 - 6.3e-07nu-fission0.0005760.000084
21116.3e-07 - 2.0e+01fission0.0000690.000004
31116.3e-07 - 2.0e+01nu-fission0.0001830.000011
41210.0e+00 - 6.3e-07fission0.0003660.000052
51210.0e+00 - 6.3e-07nu-fission0.0008920.000127
61216.3e-07 - 2.0e+01fission0.0001090.000009
71216.3e-07 - 2.0e+01nu-fission0.0002840.000021
81310.0e+00 - 6.3e-07fission0.0005400.000058
91310.0e+00 - 6.3e-07nu-fission0.0013160.000141
101316.3e-07 - 2.0e+01fission0.0001440.000017
111316.3e-07 - 2.0e+01nu-fission0.0003760.000041
121410.0e+00 - 6.3e-07fission0.0008300.000085
131410.0e+00 - 6.3e-07nu-fission0.0020220.000207
141416.3e-07 - 2.0e+01fission0.0001680.000013
151416.3e-07 - 2.0e+01nu-fission0.0004340.000034
161510.0e+00 - 6.3e-07fission0.0007380.000043
171510.0e+00 - 6.3e-07nu-fission0.0017990.000105
181516.3e-07 - 2.0e+01fission0.0001860.000010
191516.3e-07 - 2.0e+01nu-fission0.0004860.000026
\n", + "
" + ], + "text/plain": [ + " mesh 1 energy [MeV] score mean std. dev.\n", + " x y z \n", + "bin \n", + "0 1 1 1 0.0e+00 - 6.3e-07 fission 0.000236 0.000034\n", + "1 1 1 1 0.0e+00 - 6.3e-07 nu-fission 0.000576 0.000084\n", + "2 1 1 1 6.3e-07 - 2.0e+01 fission 0.000069 0.000004\n", + "3 1 1 1 6.3e-07 - 2.0e+01 nu-fission 0.000183 0.000011\n", + "4 1 2 1 0.0e+00 - 6.3e-07 fission 0.000366 0.000052\n", + "5 1 2 1 0.0e+00 - 6.3e-07 nu-fission 0.000892 0.000127\n", + "6 1 2 1 6.3e-07 - 2.0e+01 fission 0.000109 0.000009\n", + "7 1 2 1 6.3e-07 - 2.0e+01 nu-fission 0.000284 0.000021\n", + "8 1 3 1 0.0e+00 - 6.3e-07 fission 0.000540 0.000058\n", + "9 1 3 1 0.0e+00 - 6.3e-07 nu-fission 0.001316 0.000141\n", + "10 1 3 1 6.3e-07 - 2.0e+01 fission 0.000144 0.000017\n", + "11 1 3 1 6.3e-07 - 2.0e+01 nu-fission 0.000376 0.000041\n", + "12 1 4 1 0.0e+00 - 6.3e-07 fission 0.000830 0.000085\n", + "13 1 4 1 0.0e+00 - 6.3e-07 nu-fission 0.002022 0.000207\n", + "14 1 4 1 6.3e-07 - 2.0e+01 fission 0.000168 0.000013\n", + "15 1 4 1 6.3e-07 - 2.0e+01 nu-fission 0.000434 0.000034\n", + "16 1 5 1 0.0e+00 - 6.3e-07 fission 0.000738 0.000043\n", + "17 1 5 1 0.0e+00 - 6.3e-07 nu-fission 0.001799 0.000105\n", + "18 1 5 1 6.3e-07 - 2.0e+01 fission 0.000186 0.000010\n", + "19 1 5 1 6.3e-07 - 2.0e+01 nu-fission 0.000486 0.000026" + ] + }, + "execution_count": 24, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Get a pandas dataframe for the mesh tally data\n", + "df = tally.get_pandas_dataframe(nuclides=False)\n", + "\n", + "# Print the first twenty rows in the dataframe\n", + "df.head(20)" + ] + }, + { + "cell_type": "code", + "execution_count": 25, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "image/png": 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+ "text/plain": [ + "" + ] + }, + "metadata": {}, + "output_type": "display_data" + } + ], + "source": [ + "# Create a boxplot to view the distribution of\n", + "# fission and nu-fission rates in the pins\n", + "bp = df.boxplot(column='mean', by='score')" + ] + }, + { + "cell_type": "code", + "execution_count": 26, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/plain": [ + "" + ] + }, + "execution_count": 26, + "metadata": {}, + "output_type": "execute_result" + }, + { + "data": { + "image/png": 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+ "text/plain": [ + "" + ] + }, + "metadata": {}, + "output_type": "display_data" + } + ], + "source": [ + "# Extract thermal nu-fission rates from pandas\n", + "fiss = df[df['score'] == 'nu-fission']\n", + "fiss = fiss[fiss['energy [MeV]'] == '0.0e+00 - 6.3e-07']\n", + "\n", + "# Extract mean and reshape as 2D NumPy arrays\n", + "mean = fiss['mean'].reshape((17,17))\n", + "\n", + "pylab.imshow(mean, interpolation='nearest')\n", + "pylab.title('fission rate')\n", + "pylab.xlabel('x')\n", + "pylab.ylabel('y')\n", + "pylab.colorbar()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "**Analyze the cell+nuclides scatter-y2 rate tally**" + ] + }, + { + "cell_type": "code", + "execution_count": 27, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "Tally\n", + "\tID =\t10001\n", + "\tName =\tcell tally\n", + "\tFilters =\t\n", + " \t\tcell\t[10000]\n", + "\tNuclides =\tU-235 U-238 \n", + "\tScores =\t['scatter-Y0,0', 'scatter-Y1,-1', 'scatter-Y1,0', 'scatter-Y1,1', 'scatter-Y2,-2', 'scatter-Y2,-1', 'scatter-Y2,0', 'scatter-Y2,1', 'scatter-Y2,2']\n", + "\tEstimator =\tanalog\n", + "\n" + ] + } + ], + "source": [ + "# Find the cell Tally with the StatePoint API\n", + "tally = sp.get_tally(name='cell tally')\n", + "\n", + "# Print a little info about the cell tally to the screen\n", + "print(tally)" + ] + }, + { + "cell_type": "code", + "execution_count": 28, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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1710000U-238scatter-Y2,20.0000020.001718
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" + ], + "text/plain": [ + " cell nuclide score mean std. dev.\n", + "bin \n", + "0 10000 U-235 scatter-Y0,0 0.036453 0.000941\n", + "1 10000 U-235 scatter-Y1,-1 -0.000725 0.000261\n", + "2 10000 U-235 scatter-Y1,0 -0.000088 0.000408\n", + "3 10000 U-235 scatter-Y1,1 0.000986 0.000412\n", + "4 10000 U-235 scatter-Y2,-2 0.000098 0.000204\n", + "5 10000 U-235 scatter-Y2,-1 -0.000358 0.000247\n", + "6 10000 U-235 scatter-Y2,0 0.000197 0.000140\n", + "7 10000 U-235 scatter-Y2,1 -0.000084 0.000196\n", + "8 10000 U-235 scatter-Y2,2 0.000052 0.000168\n", + "9 10000 U-238 scatter-Y0,0 2.325600 0.015545\n", + "10 10000 U-238 scatter-Y1,-1 -0.030089 0.002460\n", + "11 10000 U-238 scatter-Y1,0 -0.004451 0.003663\n", + "12 10000 U-238 scatter-Y1,1 0.020832 0.002831\n", + "13 10000 U-238 scatter-Y2,-2 -0.004149 0.001530\n", + "14 10000 U-238 scatter-Y2,-1 0.000735 0.001729\n", + "15 10000 U-238 scatter-Y2,0 0.003431 0.002098\n", + "16 10000 U-238 scatter-Y2,1 0.000385 0.001263\n", + "17 10000 U-238 scatter-Y2,2 0.000002 0.001718" + ] + }, + "execution_count": 28, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Get a pandas dataframe for the cell tally data\n", + "df = tally.get_pandas_dataframe()\n", + "\n", + "# Print the first twenty rows in the dataframe\n", + "df.head(100)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Use the new Tally data retrieval API with pure NumPy" + ] + }, + { + "cell_type": "code", + "execution_count": 29, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "[[[ 0.00171834 0.01554515]\n", + " [ 0.00016768 0.00094081]]]\n" + ] + } + ], + "source": [ + "# Get the standard deviations for two of the spherical harmonic\n", + "# scattering reaction rates \n", + "data = tally.get_values(scores=['scatter-Y2,2', 'scatter-Y0,0'], \n", + " nuclides=['U-238', 'U-235'], value='std_dev')\n", + "print(data)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "**Analyze the distribcell tally**" + ] + }, + { + "cell_type": "code", + "execution_count": 30, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "Tally\n", + "\tID =\t10002\n", + "\tName =\tdistribcell tally\n", + "\tFilters =\t\n", + " \t\tdistribcell\t[10002]\n", + "\tNuclides =\ttotal \n", + "\tScores =\t['absorption', 'scatter']\n", + "\tEstimator =\ttracklength\n", + "\n" + ] + } + ], + "source": [ + "# Find the distribcell Tally with the StatePoint API\n", + "tally = sp.get_tally(name='distribcell tally')\n", + "\n", + "# Print a little info about the distribcell tally to the screen\n", + "print(tally)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Use the new Tally data retrieval API with pure NumPy" + ] + }, + { + "cell_type": "code", + "execution_count": 31, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "[[[ 0.04682759]]\n", + "\n", + " [[ 0.03205271]]\n", + "\n", + " [[ 0.03592433]]\n", + "\n", + " [[ 0.02417979]]\n", + "\n", + " [[ 0.02524314]]\n", + "\n", + " [[ 0.02390359]]\n", + "\n", + " [[ 0.0274475 ]]\n", + "\n", + " [[ 0.02827721]]\n", + "\n", + " [[ 0.0231313 ]]\n", + "\n", + " [[ 0.01898386]]]\n" + ] + } + ], + "source": [ + "# Get the relative error for the scattering reaction rates in\n", + "# the first 30 distribcell instances \n", + "data = tally.get_values(scores=['scatter'], filters=['distribcell'],\n", + " filter_bins=[range(10)], value='rel_err')\n", + "print(data)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Print the distribcell tally dataframe **without** OpenCG info" + ] + }, + { + "cell_type": "code", + "execution_count": 32, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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distribcellscoremeanstd. dev.
bin
558279absorption0.0000950.000009
559279scatter0.0136110.000544
560280absorption0.0000960.000009
561280scatter0.0139990.000568
562281absorption0.0001170.000015
563281scatter0.0159510.000682
564282absorption0.0001040.000011
565282scatter0.0160570.000574
566283absorption0.0001170.000013
567283scatter0.0159970.000706
568284absorption0.0001080.000007
569284scatter0.0167200.000639
570285absorption0.0001160.000008
571285scatter0.0177640.000639
572286absorption0.0001110.000014
573286scatter0.0181010.000766
574287absorption0.0001150.000012
575287scatter0.0184110.000655
576288absorption0.0001380.000014
577288scatter0.0191540.000763
\n", + "
" + ], + "text/plain": [ + " distribcell score mean std. dev.\n", + "bin \n", + "558 279 absorption 0.000095 0.000009\n", + "559 279 scatter 0.013611 0.000544\n", + "560 280 absorption 0.000096 0.000009\n", + "561 280 scatter 0.013999 0.000568\n", + "562 281 absorption 0.000117 0.000015\n", + "563 281 scatter 0.015951 0.000682\n", + "564 282 absorption 0.000104 0.000011\n", + "565 282 scatter 0.016057 0.000574\n", + "566 283 absorption 0.000117 0.000013\n", + "567 283 scatter 0.015997 0.000706\n", + "568 284 absorption 0.000108 0.000007\n", + "569 284 scatter 0.016720 0.000639\n", + "570 285 absorption 0.000116 0.000008\n", + "571 285 scatter 0.017764 0.000639\n", + "572 286 absorption 0.000111 0.000014\n", + "573 286 scatter 0.018101 0.000766\n", + "574 287 absorption 0.000115 0.000012\n", + "575 287 scatter 0.018411 0.000655\n", + "576 288 absorption 0.000138 0.000014\n", + "577 288 scatter 0.019154 0.000763" + ] + }, + "execution_count": 32, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Get a pandas dataframe for the distribcell tally data\n", + "df = tally.get_pandas_dataframe(nuclides=False)\n", + "\n", + "# Print the last twenty rows in the dataframe\n", + "df.tail(20)" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Print the distribcell tally dataframe **with** OpenCG info" + ] + }, + { + "cell_type": "code", + "execution_count": 33, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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level 1level 2level 3distribcellscoremeanstd. dev.
cellunivlatcelluniv
idididxyzidid
bin
01000301000100010002100000absorption0.0001220.000010
11000301000100010002100000scatter0.0185960.000871
21000301000110010002100001absorption0.0002060.000014
31000301000110010002100001scatter0.0297330.000953
41000301000120010002100002absorption0.0002800.000018
51000301000120010002100002scatter0.0384940.001383
61000301000130010002100003absorption0.0003840.000026
71000301000130010002100003scatter0.0488390.001181
81000301000140010002100004absorption0.0004570.000023
91000301000140010002100004scatter0.0580610.001466
101000301000150010002100005absorption0.0004940.000026
111000301000150010002100005scatter0.0658740.001575
121000301000160010002100006absorption0.0004900.000032
131000301000160010002100006scatter0.0724200.001988
141000301000170010002100007absorption0.0006050.000042
151000301000170010002100007scatter0.0788020.002228
161000301000180010002100008absorption0.0006270.000037
171000301000180010002100008scatter0.0836840.001936
181000301000190010002100009absorption0.0007110.000040
191000301000190010002100009scatter0.0889890.001689
\n", + "
" + ], + "text/plain": [ + " level 1 level 2 level 3 distribcell score \\\n", + " cell univ lat cell univ \n", + " id id id x y z id id \n", + "bin \n", + "0 10003 0 10001 0 0 0 10002 10000 0 absorption \n", + "1 10003 0 10001 0 0 0 10002 10000 0 scatter \n", + "2 10003 0 10001 1 0 0 10002 10000 1 absorption \n", + "3 10003 0 10001 1 0 0 10002 10000 1 scatter \n", + "4 10003 0 10001 2 0 0 10002 10000 2 absorption \n", + "5 10003 0 10001 2 0 0 10002 10000 2 scatter \n", + "6 10003 0 10001 3 0 0 10002 10000 3 absorption \n", + "7 10003 0 10001 3 0 0 10002 10000 3 scatter \n", + "8 10003 0 10001 4 0 0 10002 10000 4 absorption \n", + "9 10003 0 10001 4 0 0 10002 10000 4 scatter \n", + "10 10003 0 10001 5 0 0 10002 10000 5 absorption \n", + "11 10003 0 10001 5 0 0 10002 10000 5 scatter \n", + "12 10003 0 10001 6 0 0 10002 10000 6 absorption \n", + "13 10003 0 10001 6 0 0 10002 10000 6 scatter \n", + "14 10003 0 10001 7 0 0 10002 10000 7 absorption \n", + "15 10003 0 10001 7 0 0 10002 10000 7 scatter \n", + "16 10003 0 10001 8 0 0 10002 10000 8 absorption \n", + "17 10003 0 10001 8 0 0 10002 10000 8 scatter \n", + "18 10003 0 10001 9 0 0 10002 10000 9 absorption \n", + "19 10003 0 10001 9 0 0 10002 10000 9 scatter \n", + "\n", + " mean std. dev. \n", + " \n", + " \n", + "bin \n", + "0 0.000122 0.000010 \n", + "1 0.018596 0.000871 \n", + "2 0.000206 0.000014 \n", + "3 0.029733 0.000953 \n", + "4 0.000280 0.000018 \n", + "5 0.038494 0.001383 \n", + "6 0.000384 0.000026 \n", + "7 0.048839 0.001181 \n", + "8 0.000457 0.000023 \n", + "9 0.058061 0.001466 \n", + "10 0.000494 0.000026 \n", + "11 0.065874 0.001575 \n", + "12 0.000490 0.000032 \n", + "13 0.072420 0.001988 \n", + "14 0.000605 0.000042 \n", + "15 0.078802 0.002228 \n", + "16 0.000627 0.000037 \n", + "17 0.083684 0.001936 \n", + "18 0.000711 0.000040 \n", + "19 0.088989 0.001689 " + ] + }, + "execution_count": 33, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Get a pandas dataframe for the distribcell tally data\n", + "df = tally.get_pandas_dataframe(summary=su, nuclides=False)\n", + "\n", + "# Print the last twenty rows in the dataframe\n", + "df.head(20)" + ] + }, + { + "cell_type": "code", + "execution_count": 34, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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meanstd. dev.
count289.000000289.000000
mean0.0004140.000025
std0.0002410.000010
min0.0000130.000003
25%0.0002040.000017
50%0.0003870.000024
75%0.0005940.000031
max0.0009190.000060
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" + ], + "text/plain": [ + " mean std. dev.\n", + " \n", + " \n", + "count 289.000000 289.000000\n", + "mean 0.000414 0.000025\n", + "std 0.000241 0.000010\n", + "min 0.000013 0.000003\n", + "25% 0.000204 0.000017\n", + "50% 0.000387 0.000024\n", + "75% 0.000594 0.000031\n", + "max 0.000919 0.000060" + ] + }, + "execution_count": 34, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Show summary statistics for absorption distribcell tally data\n", + "absorption = df[df['score'] == 'absorption']\n", + "absorption[['mean', 'std. dev.']].dropna().describe()\n", + "\n", + "# Note that the maximum standard deviation does indeed\n", + "# meet the 5e-4 threshold set by the tally trigger" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Perform a statistical test comparing the tally sample distributions for two categories of fuel pins." + ] + }, + { + "cell_type": "code", + "execution_count": 35, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "Mann-Whitney Test p-value: 0.378626583393\n" + ] + } + ], + "source": [ + "# Extract tally data from pins in the pins divided along y=x diagonal \n", + "multi_index = ('level 2', 'lat',)\n", + "lower = df[df[multi_index + ('x',)] + df[multi_index + ('y',)] < 16]\n", + "upper = df[df[multi_index + ('x',)] + df[multi_index + ('y',)] > 16]\n", + "lower = lower[lower['score'] == 'absorption']\n", + "upper = upper[upper['score'] == 'absorption']\n", + "\n", + "# Perform non-parametric Mann-Whitney U Test to see if the \n", + "# absorption rates (may) come from same sampling distribution\n", + "u, p = scipy.stats.mannwhitneyu(lower['mean'], upper['mean'])\n", + "print('Mann-Whitney Test p-value: {0}'.format(p))" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Note that the symmetry implied by the y=x diagonal ensures that the two sampling distributions are identical. Indeed, as illustrated by the test above, for any reasonable significance level (*e.g.*, $\\alpha$=0.05) one would **not reject** the null hypothesis that the two sampling distributions are identical.\n", + "\n", + "Next, perform the same test but with two groupings of pins which are not symmetrically identical to one another." + ] + }, + { + "cell_type": "code", + "execution_count": 36, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stdout", + "output_type": "stream", + "text": [ + "Mann-Whitney Test p-value: 7.18782749267e-43\n" + ] + } + ], + "source": [ + "# Extract tally data from pins in the pins divided along y=-x diagonal\n", + "multi_index = ('level 2', 'lat',)\n", + "lower = df[df[multi_index + ('x',)] > df[multi_index + ('y',)]]\n", + "upper = df[df[multi_index + ('x',)] < df[multi_index + ('y',)]]\n", + "lower = lower[lower['score'] == 'absorption']\n", + "upper = upper[upper['score'] == 'absorption']\n", + "\n", + "# Perform non-parametric Mann-Whitney U Test to see if the \n", + "# absorption rates (may) come from same sampling distribution\n", + "u, p = scipy.stats.mannwhitneyu(lower['mean'], upper['mean'])\n", + "print('Mann-Whitney Test p-value: {0}'.format(p))" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Note that the asymmetry implied by the y=-x diagonal ensures that the two sampling distributions are *not* identical. Indeed, as illustrated by the test above, for any reasonable significance level (*e.g.*, $\\alpha$=0.05) one would **reject** the null hypothesis that the two sampling distributions are identical." + ] + }, + { + "cell_type": "code", + "execution_count": 37, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "name": "stderr", + "output_type": "stream", + "text": [ + "/usr/local/lib/python2.7/dist-packages/IPython/kernel/__main__.py:4: SettingWithCopyWarning: \n", + "A value is trying to be set on a copy of a slice from a DataFrame.\n", + "Try using .loc[row_indexer,col_indexer] = value instead\n", + "\n", + "See the the caveats in the documentation: http://pandas.pydata.org/pandas-docs/stable/indexing.html#indexing-view-versus-copy\n" + ] + }, + { + "data": { + "text/plain": [ + "" + ] + }, + "execution_count": 37, + "metadata": {}, + "output_type": "execute_result" + }, + { + "data": { + "image/png": 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YPOCYT4pyCyLDPks89Li7+284/vgJiTtkPvbYY0ydGmyWesYZ7+Kkk4qzFW3e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\nIUTmSLkIIYTInP8HkW6mvM8NxhcAAAAASUVORK5CYII=\n", + "text/plain": [ + "" + ] + }, + "metadata": {}, + "output_type": "display_data" + } + ], + "source": [ + "# Extract the scatter tally data from pandas\n", + "scatter = df[df['score'] == 'scatter']\n", + "\n", + "scatter['rel. err.'] = scatter['std. dev.'] / scatter['mean']\n", + "\n", + "# Show a scatter plot of the mean vs. the std. dev.\n", + "scatter.plot(kind='scatter', x='mean', y='rel. err.', title='Scattering Rates')" + ] + }, + { + "cell_type": "code", + "execution_count": 38, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/plain": [ + "" + ] + }, + "execution_count": 38, + "metadata": {}, + "output_type": "execute_result" + }, + { + "data": { + "image/png": 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i/Yqok0iKRFYUzGyemU0xs8lmNimqHJIiLT6DHzpHnUIqakMTmAFPT3k66iSS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\nn0kGUfeRSOAJYJC7f1Nm+tv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+ "text/plain": [ + "" + ] + }, + "metadata": {}, + "output_type": "display_data" + } + ], + "source": [ + "# Plot a histogram and kernel density estimate for the scattering rates\n", + "scatter['mean'].plot(kind='hist', bins=25)\n", + "scatter['mean'].plot(kind='kde')\n", + "pylab.title('Scattering Rates')\n", + "pylab.xlabel('Mean')\n", + "pylab.legend(['KDE', 'Histogram'])" + ] + } + ], + "metadata": { + "kernelspec": { + "display_name": "Python 2", + "language": "python", + "name": "python2" + }, + "language_info": { + "codemirror_mode": { + "name": "ipython", + "version": 2 + }, + "file_extension": ".py", + "mimetype": "text/x-python", + "name": "python", + "nbconvert_exporter": "python", + "pygments_lexer": "ipython2", + "version": "2.7.8" + } + }, + "nbformat": 4, + "nbformat_minor": 0 +} diff --git a/docs/source/pythonapi/examples/pandas-dataframes.rst b/docs/source/pythonapi/examples/pandas-dataframes.rst new file mode 100644 index 000000000..7eacf4d32 --- /dev/null +++ b/docs/source/pythonapi/examples/pandas-dataframes.rst @@ -0,0 +1,11 @@ +================= +Pandas Dataframes +================= + +.. only:: html + + .. notebook:: pandas-dataframes.ipynb + +.. only:: latex + + IPython notebooks must be viewed in the online HTML documentation. diff --git a/docs/source/pythonapi/index.rst b/docs/source/pythonapi/index.rst index 253362597..6e272b155 100644 --- a/docs/source/pythonapi/index.rst +++ b/docs/source/pythonapi/index.rst @@ -6,7 +6,7 @@ Python API OpenMC includes a rich Python API that enables programmatic pre- and post-processing. The easiest way to begin using the API is to take a look at the -example IPython notebooks provided. The full API documentation serves to provide +example Jupyter notebooks provided. The full API documentation serves to provide more information on a given module or class. **Handling nuclear data:** @@ -53,9 +53,10 @@ more information on a given module or class. summary tallies -**Examples:** +**Example Jupyter Notebooks:** .. toctree:: :maxdepth: 1 + examples/pandas-dataframes examples/tally-arithmetic From e550a8de27a7da0a7584ca09ddab54005126f95c Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Mon, 10 Aug 2015 06:54:02 +0700 Subject: [PATCH 04/43] Fix bug in get_unique_universes introduced by #425 --- openmc/universe.py | 3 ++- 1 file changed, 2 insertions(+), 1 deletion(-) diff --git a/openmc/universe.py b/openmc/universe.py index 75b673746..cdec833cb 100644 --- a/openmc/universe.py +++ b/openmc/universe.py @@ -714,7 +714,8 @@ class Lattice(object): assert isinstance(u, Universe) univs[u._id] = u - univs[self._outer._id] = self._outer + if self._outer is not None: + univs[self._outer._id] = self._outer return univs From 20d915809af47949dcaae515578e0fa35e8934ae Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Mon, 10 Aug 2015 06:54:33 +0700 Subject: [PATCH 05/43] Make sure plotting geometry works in two notebooks --- .../examples/pandas-dataframes.ipynb | 131 ++++++++++-------- .../pythonapi/examples/tally-arithmetic.ipynb | 36 ++--- 2 files changed, 88 insertions(+), 79 deletions(-) diff --git a/docs/source/pythonapi/examples/pandas-dataframes.ipynb b/docs/source/pythonapi/examples/pandas-dataframes.ipynb index 485420565..6d7dff9c1 100644 --- a/docs/source/pythonapi/examples/pandas-dataframes.ipynb +++ b/docs/source/pythonapi/examples/pandas-dataframes.ipynb @@ -358,6 +358,19 @@ "metadata": { "collapsed": false }, + "outputs": [], + "source": [ + "# Run openmc in plotting mode\n", + "executor = openmc.Executor()\n", + "executor.plot_geometry(output=False)" + ] + }, + { + "cell_type": "code", + "execution_count": 14, + "metadata": { + "collapsed": false + }, "outputs": [ { "data": { @@ -366,16 +379,12 @@ "" ] }, - "execution_count": 13, + "execution_count": 14, "metadata": {}, "output_type": "execute_result" } ], "source": [ - "# Run openmc in plotting mode\n", - "executor = openmc.Executor()\n", - "executor.plot_geometry(output=False)\n", - "\n", "# Convert OpenMC's funky ppm to png\n", "!convert materials-xy.ppm materials-xy.png\n", "\n", @@ -392,7 +401,7 @@ }, { "cell_type": "code", - "execution_count": 14, + "execution_count": 15, "metadata": { "collapsed": true }, @@ -412,7 +421,7 @@ }, { "cell_type": "code", - "execution_count": 15, + "execution_count": 16, "metadata": { "collapsed": false }, @@ -455,7 +464,7 @@ }, { "cell_type": "code", - "execution_count": 16, + "execution_count": 17, "metadata": { "collapsed": false }, @@ -484,7 +493,7 @@ }, { "cell_type": "code", - "execution_count": 17, + "execution_count": 18, "metadata": { "collapsed": true }, @@ -510,7 +519,7 @@ }, { "cell_type": "code", - "execution_count": 18, + "execution_count": 19, "metadata": { "collapsed": true }, @@ -529,7 +538,7 @@ }, { "cell_type": "code", - "execution_count": 19, + "execution_count": 20, "metadata": { "collapsed": false }, @@ -554,7 +563,7 @@ " Copyright: 2011-2015 Massachusetts Institute of Technology\n", " License: http://mit-crpg.github.io/openmc/license.html\n", " Version: 0.6.2\n", - " Date/Time: 2015-08-08 09:29:37\n", + " Date/Time: 2015-08-10 06:49:48\n", " MPI Processes: 4\n", "\n", " ===========================================================================\n", @@ -621,20 +630,20 @@ "\n", " =======================> TIMING STATISTICS <=======================\n", "\n", - " Total time for initialization = 9.4600E-01 seconds\n", - " Reading cross sections = 2.8400E-01 seconds\n", - " Total time in simulation = 5.9780E+00 seconds\n", - " Time in transport only = 5.6820E+00 seconds\n", - " Time in inactive batches = 7.8500E-01 seconds\n", - " Time in active batches = 5.1930E+00 seconds\n", - " Time synchronizing fission bank = 2.3000E-01 seconds\n", - " Sampling source sites = 1.0000E-03 seconds\n", - " SEND/RECV source sites = 2.0000E-03 seconds\n", - " Time accumulating tallies = 2.0000E-03 seconds\n", - " Total time for finalization = 1.0000E-03 seconds\n", - " Total time elapsed = 6.9280E+00 seconds\n", - " Calculation Rate (inactive) = 15923.6 neutrons/second\n", - " Calculation Rate (active) = 7221.26 neutrons/second\n", + " Total time for initialization = 9.4100E-01 seconds\n", + " Reading cross sections = 2.9400E-01 seconds\n", + " Total time in simulation = 7.4740E+00 seconds\n", + " Time in transport only = 6.3910E+00 seconds\n", + " Time in inactive batches = 8.9600E-01 seconds\n", + " Time in active batches = 6.5780E+00 seconds\n", + " Time synchronizing fission bank = 9.9000E-01 seconds\n", + " Sampling source sites = 4.7000E-02 seconds\n", + " SEND/RECV source sites = 0.0000E+00 seconds\n", + " Time accumulating tallies = 6.0000E-03 seconds\n", + " Total time for finalization = 0.0000E+00 seconds\n", + " Total time elapsed = 8.4190E+00 seconds\n", + " Calculation Rate (inactive) = 13950.9 neutrons/second\n", + " Calculation Rate (active) = 5700.82 neutrons/second\n", "\n", " ============================> RESULTS <============================\n", "\n", @@ -652,7 +661,7 @@ "0" ] }, - "execution_count": 19, + "execution_count": 20, "metadata": {}, "output_type": "execute_result" } @@ -674,7 +683,7 @@ }, { "cell_type": "code", - "execution_count": 20, + "execution_count": 21, "metadata": { "collapsed": false }, @@ -692,7 +701,7 @@ }, { "cell_type": "code", - "execution_count": 21, + "execution_count": 22, "metadata": { "collapsed": false, "scrolled": true @@ -713,7 +722,7 @@ }, { "cell_type": "code", - "execution_count": 22, + "execution_count": 23, "metadata": { "collapsed": false }, @@ -752,7 +761,7 @@ }, { "cell_type": "code", - "execution_count": 23, + "execution_count": 24, "metadata": { "collapsed": false }, @@ -806,7 +815,7 @@ }, { "cell_type": "code", - "execution_count": 24, + "execution_count": 25, "metadata": { "collapsed": false }, @@ -1077,7 +1086,7 @@ "19 1 5 1 6.3e-07 - 2.0e+01 nu-fission 0.000486 0.000026" ] }, - "execution_count": 24, + "execution_count": 25, "metadata": {}, "output_type": "execute_result" } @@ -1092,7 +1101,7 @@ }, { "cell_type": "code", - "execution_count": 25, + "execution_count": 26, "metadata": { "collapsed": false }, @@ -1101,7 +1110,7 @@ "data": { "image/png": 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"text/plain": [ - "" + "" ] }, "metadata": {}, @@ -1116,7 +1125,7 @@ }, { "cell_type": "code", - "execution_count": 26, + "execution_count": 27, "metadata": { "collapsed": false }, @@ -1124,10 +1133,10 @@ { "data": { "text/plain": [ - "" + "" ] }, - "execution_count": 26, + "execution_count": 27, "metadata": {}, "output_type": "execute_result" }, @@ -1135,7 +1144,7 @@ "data": { "image/png": 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FJ00za7/qq1HOBLojoicieoGbgLkNdc4CrgeIiAeBsZImNIuNiBUR8XhBe3OB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\nTkSuQmCC\n", "text/plain": [ - "" + "" ] }, "metadata": {}, @@ -1166,7 +1175,7 @@ }, { "cell_type": "code", - "execution_count": 27, + "execution_count": 28, "metadata": { "collapsed": false }, @@ -1197,7 +1206,7 @@ }, { "cell_type": "code", - "execution_count": 28, + "execution_count": 29, "metadata": { "collapsed": false }, @@ -1397,7 +1406,7 @@ "17 10000 U-238 scatter-Y2,2 0.000002 0.001718" ] }, - "execution_count": 28, + "execution_count": 29, "metadata": {}, "output_type": "execute_result" } @@ -1419,7 +1428,7 @@ }, { "cell_type": "code", - "execution_count": 29, + "execution_count": 30, "metadata": { "collapsed": false }, @@ -1450,7 +1459,7 @@ }, { "cell_type": "code", - "execution_count": 30, + "execution_count": 31, "metadata": { "collapsed": false }, @@ -1488,7 +1497,7 @@ }, { "cell_type": "code", - "execution_count": 31, + "execution_count": 32, "metadata": { "collapsed": false }, @@ -1536,7 +1545,7 @@ }, { "cell_type": "code", - "execution_count": 32, + "execution_count": 33, "metadata": { "collapsed": false }, @@ -1732,7 +1741,7 @@ "577 288 scatter 0.019154 0.000763" ] }, - "execution_count": 32, + "execution_count": 33, "metadata": {}, "output_type": "execute_result" } @@ -1754,7 +1763,7 @@ }, { "cell_type": "code", - "execution_count": 33, + "execution_count": 34, "metadata": { "collapsed": false }, @@ -2175,7 +2184,7 @@ "19 0.088989 0.001689 " ] }, - "execution_count": 33, + "execution_count": 34, "metadata": {}, "output_type": "execute_result" } @@ -2190,7 +2199,7 @@ }, { "cell_type": "code", - "execution_count": 34, + "execution_count": 35, "metadata": { "collapsed": false }, @@ -2276,7 +2285,7 @@ "max 0.000919 0.000060" ] }, - "execution_count": 34, + "execution_count": 35, "metadata": {}, "output_type": "execute_result" } @@ -2299,7 +2308,7 @@ }, { "cell_type": "code", - "execution_count": 35, + "execution_count": 36, "metadata": { "collapsed": false }, @@ -2337,7 +2346,7 @@ }, { "cell_type": "code", - "execution_count": 36, + "execution_count": 37, "metadata": { "collapsed": false }, @@ -2373,7 +2382,7 @@ }, { "cell_type": "code", - "execution_count": 37, + "execution_count": 38, "metadata": { "collapsed": false }, @@ -2392,10 +2401,10 @@ { "data": { "text/plain": [ - "" + "" ] }, - "execution_count": 37, + "execution_count": 38, "metadata": {}, "output_type": "execute_result" }, @@ -2403,7 +2412,7 @@ "data": { "image/png": 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"text/plain": [ - "" + "" ] }, "metadata": {}, @@ -2422,7 +2431,7 @@ }, { "cell_type": "code", - "execution_count": 38, + "execution_count": 39, "metadata": { "collapsed": false }, @@ -2430,10 +2439,10 @@ { "data": { "text/plain": [ - "" + "" ] }, - "execution_count": 38, + "execution_count": 39, "metadata": {}, "output_type": "execute_result" }, @@ -2441,7 +2450,7 @@ "data": { "image/png": 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i/Yqok0iKRFYUzGyemU0xs8lmNimqHJIiLT6DHzpHnUIqakMTmAFPT3k66iSS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\nRUFERGJUFEREJEZFQUREYlQUREQk5v8DDXXJy8JrhoYAAAAASUVORK5CYII=\n", "text/plain": [ - "" + "" ] }, "metadata": {}, diff --git a/docs/source/pythonapi/examples/tally-arithmetic.ipynb b/docs/source/pythonapi/examples/tally-arithmetic.ipynb index 3223f23aa..e68aa36d6 100644 --- a/docs/source/pythonapi/examples/tally-arithmetic.ipynb +++ b/docs/source/pythonapi/examples/tally-arithmetic.ipynb @@ -346,10 +346,7 @@ "source": [ "# Run openmc in plotting mode\n", "executor = openmc.Executor()\n", - "executor.plot_geometry(output=False)\n", - "\n", - "# Convert OpenMC's funky ppm to png\n", - "!convert materials-xy.ppm materials-xy.png" + "executor.plot_geometry(output=False)" ] }, { @@ -372,6 +369,9 @@ } ], "source": [ + "# Convert OpenMC's funky ppm to png\n", + "!convert materials-xy.ppm materials-xy.png\n", + "\n", "# Display the materials plot inline\n", "Image(filename='materials-xy.png')" ] @@ -572,7 +572,7 @@ " Copyright: 2011-2015 Massachusetts Institute of Technology\n", " License: http://mit-crpg.github.io/openmc/license.html\n", " Version: 0.6.2\n", - " Date/Time: 2015-08-07 11:12:08\n", + " Date/Time: 2015-08-10 06:51:18\n", " MPI Processes: 4\n", "\n", " ===========================================================================\n", @@ -628,20 +628,20 @@ "\n", " =======================> TIMING STATISTICS <=======================\n", "\n", - " Total time for initialization = 9.0500E-01 seconds\n", - " Reading cross sections = 2.6500E-01 seconds\n", - " Total time in simulation = 8.9630E+00 seconds\n", - " Time in transport only = 8.1580E+00 seconds\n", - " Time in inactive batches = 1.0700E+00 seconds\n", - " Time in active batches = 7.8930E+00 seconds\n", - " Time synchronizing fission bank = 7.6400E-01 seconds\n", - " Sampling source sites = 4.0000E-03 seconds\n", - " SEND/RECV source sites = 1.0000E-03 seconds\n", - " Time accumulating tallies = 1.0000E-03 seconds\n", + " Total time for initialization = 8.9900E-01 seconds\n", + " Reading cross sections = 2.5700E-01 seconds\n", + " Total time in simulation = 9.5070E+00 seconds\n", + " Time in transport only = 8.6890E+00 seconds\n", + " Time in inactive batches = 1.0080E+00 seconds\n", + " Time in active batches = 8.4990E+00 seconds\n", + " Time synchronizing fission bank = 7.8300E-01 seconds\n", + " Sampling source sites = 4.4000E-02 seconds\n", + " SEND/RECV source sites = 0.0000E+00 seconds\n", + " Time accumulating tallies = 3.0000E-03 seconds\n", " Total time for finalization = 2.0000E-03 seconds\n", - " Total time elapsed = 9.8710E+00 seconds\n", - " Calculation Rate (inactive) = 11682.2 neutrons/second\n", - " Calculation Rate (active) = 4751.05 neutrons/second\n", + " Total time elapsed = 1.0410E+01 seconds\n", + " Calculation Rate (inactive) = 12400.8 neutrons/second\n", + " Calculation Rate (active) = 4412.28 neutrons/second\n", "\n", " ============================> RESULTS <============================\n", "\n", From 8fd058a11ec875cb7760e0ee99ee82617bbfd46c Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Mon, 10 Aug 2015 12:57:35 +0700 Subject: [PATCH 06/43] Use property decorators for Lattice.outer --- openmc/universe.py | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/openmc/universe.py b/openmc/universe.py index cdec833cb..bab10f5df 100644 --- a/openmc/universe.py +++ b/openmc/universe.py @@ -714,8 +714,8 @@ class Lattice(object): assert isinstance(u, Universe) univs[u._id] = u - if self._outer is not None: - univs[self._outer._id] = self._outer + if self.outer is not None: + univs[self.outer._id] = self.outer return univs From 812858cca0fd838ba77511d4a857e178eb109508 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Mon, 10 Aug 2015 12:59:04 +0700 Subject: [PATCH 07/43] Fix typo in tally-arithmetic notebook --- docs/source/pythonapi/examples/tally-arithmetic.ipynb | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/docs/source/pythonapi/examples/tally-arithmetic.ipynb b/docs/source/pythonapi/examples/tally-arithmetic.ipynb index e68aa36d6..64681b424 100644 --- a/docs/source/pythonapi/examples/tally-arithmetic.ipynb +++ b/docs/source/pythonapi/examples/tally-arithmetic.ipynb @@ -725,7 +725,7 @@ "cell_type": "markdown", "metadata": {}, "source": [ - "We have a tally of the total fission rate and the total absorption rate, so we can calculating k-infinity as:\n", + "We have a tally of the total fission rate and the total absorption rate, so we can calculate k-infinity as:\n", "$$k_\\infty = \\frac{\\nu \\Sigma_f \\phi}{\\Sigma_a \\phi}$$" ] }, From 8fff5b1810720d0d8b3450e892c0b7906ce2b158 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Mon, 10 Aug 2015 13:11:05 +0700 Subject: [PATCH 08/43] Add links to Python resources in main Python API doc page --- docs/source/pythonapi/index.rst | 13 +++++++++++-- 1 file changed, 11 insertions(+), 2 deletions(-) diff --git a/docs/source/pythonapi/index.rst b/docs/source/pythonapi/index.rst index 6e272b155..8c42f2d7e 100644 --- a/docs/source/pythonapi/index.rst +++ b/docs/source/pythonapi/index.rst @@ -6,8 +6,12 @@ Python API OpenMC includes a rich Python API that enables programmatic pre- and post-processing. The easiest way to begin using the API is to take a look at the -example Jupyter notebooks provided. The full API documentation serves to provide -more information on a given module or class. +example Jupyter_ notebooks provided. However, this assumes that you are already +familiar with Python and common third-party packages such as NumPy_. If you have +never programmed in Python before, there are many good tutorials available +online. We recommend going through the modules from Codecademy_ and/or the +`Scipy lectures`_. The full API documentation serves to provide more information +on a given module or class. **Handling nuclear data:** @@ -60,3 +64,8 @@ more information on a given module or class. examples/pandas-dataframes examples/tally-arithmetic + +.. _Jupyter: https://jupyter.org/ +.. _NumPy: http://www.numpy.org/ +.. _Codecademy: https://www.codecademy.com/tracks/python +.. _Scipy lectures: https://scipy-lectures.github.io/ From 0d75cbf8c1fe8bbc1fe62eca11c4586af1b90e86 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Mon, 10 Aug 2015 13:26:12 +0700 Subject: [PATCH 09/43] Update tally arithmetic notebook to fix an error in thermal flux utilization. Also make equations prettier. --- .../pythonapi/examples/tally-arithmetic.ipynb | 57 +++++++++++-------- 1 file changed, 32 insertions(+), 25 deletions(-) diff --git a/docs/source/pythonapi/examples/tally-arithmetic.ipynb b/docs/source/pythonapi/examples/tally-arithmetic.ipynb index 64681b424..9d2a81493 100644 --- a/docs/source/pythonapi/examples/tally-arithmetic.ipynb +++ b/docs/source/pythonapi/examples/tally-arithmetic.ipynb @@ -572,7 +572,7 @@ " Copyright: 2011-2015 Massachusetts Institute of Technology\n", " License: http://mit-crpg.github.io/openmc/license.html\n", " Version: 0.6.2\n", - " Date/Time: 2015-08-10 06:51:18\n", + " Date/Time: 2015-08-10 13:21:32\n", " MPI Processes: 4\n", "\n", " ===========================================================================\n", @@ -628,20 +628,20 @@ "\n", " =======================> TIMING STATISTICS <=======================\n", "\n", - " Total time for initialization = 8.9900E-01 seconds\n", - " Reading cross sections = 2.5700E-01 seconds\n", - " Total time in simulation = 9.5070E+00 seconds\n", - " Time in transport only = 8.6890E+00 seconds\n", - " Time in inactive batches = 1.0080E+00 seconds\n", - " Time in active batches = 8.4990E+00 seconds\n", - " Time synchronizing fission bank = 7.8300E-01 seconds\n", - " Sampling source sites = 4.4000E-02 seconds\n", - " SEND/RECV source sites = 0.0000E+00 seconds\n", - " Time accumulating tallies = 3.0000E-03 seconds\n", + " Total time for initialization = 1.4260E+00 seconds\n", + " Reading cross sections = 3.8800E-01 seconds\n", + " Total time in simulation = 9.0700E+00 seconds\n", + " Time in transport only = 8.3270E+00 seconds\n", + " Time in inactive batches = 1.4110E+00 seconds\n", + " Time in active batches = 7.6590E+00 seconds\n", + " Time synchronizing fission bank = 6.7300E-01 seconds\n", + " Sampling source sites = 1.1000E-02 seconds\n", + " SEND/RECV source sites = 2.0000E-03 seconds\n", + " Time accumulating tallies = 1.0000E-03 seconds\n", " Total time for finalization = 2.0000E-03 seconds\n", - " Total time elapsed = 1.0410E+01 seconds\n", - " Calculation Rate (inactive) = 12400.8 neutrons/second\n", - " Calculation Rate (active) = 4412.28 neutrons/second\n", + " Total time elapsed = 1.0500E+01 seconds\n", + " Calculation Rate (inactive) = 8858.97 neutrons/second\n", + " Calculation Rate (active) = 4896.20 neutrons/second\n", "\n", " ============================> RESULTS <============================\n", "\n", @@ -726,7 +726,8 @@ "metadata": {}, "source": [ "We have a tally of the total fission rate and the total absorption rate, so we can calculate k-infinity as:\n", - "$$k_\\infty = \\frac{\\nu \\Sigma_f \\phi}{\\Sigma_a \\phi}$$" + "$$k_\\infty = \\frac{\\langle \\nu \\Sigma_f \\phi \\rangle}{\\langle \\Sigma_a \\phi \\rangle}$$\n", + "In this notation, $\\langle \\cdot \\rangle^a_b$ represents an OpenMC that is integrated over region $a$ and energy range $b$. If $a$ or $b$ is not reported, it means the value represents an integral over all space or all energy, respectively." ] }, { @@ -794,7 +795,7 @@ "source": [ "Notice that even though the neutron production rate and absorption rate are separate tallies, we still get a first-order estimate of the uncertainty on the quotient of them automatically!\n", "\n", - "Now, let's analyze of few of the classic factors in the four-factor formula, starting with the resonance escape probability, which we'll define as $$p=\\frac{\\Sigma_{a,thermal}\\phi}{\\Sigma_a\\phi}$$" + "Now, let's analyze of few of the classic factors in the four-factor formula, starting with the resonance escape probability, which we'll define as $$p=\\frac{\\langle\\Sigma_a\\phi\\rangle_T}{\\langle\\Sigma_a\\phi\\rangle}$$ where the subscript $T$ means thermal energies." ] }, { @@ -860,7 +861,7 @@ "metadata": {}, "source": [ "The fast fission factor can be calculated as\n", - "$$\\epsilon=\\frac{\\Sigma_f\\phi}{\\Sigma_{f,thermal}\\phi}$$" + "$$\\epsilon=\\frac{\\langle\\Sigma_f\\phi\\rangle}{\\langle\\Sigma_f\\phi\\rangle_T}$$" ] }, { @@ -927,8 +928,8 @@ "metadata": {}, "source": [ "The thermal flux utilization is calculated as\n", - "$$f=\\frac{\\Sigma_{a,thermal}^F\\phi}{\\Sigma_a\\phi}$$\n", - "where $F$ denotes fuel." + "$$f=\\frac{\\langle\\Sigma_a\\phi\\rangle^F_T}{\\langle\\Sigma_a\\phi\\rangle_T}$$\n", + "where the superscript $F$ denotes fuel." ] }, { @@ -946,6 +947,8 @@ " \n", " \n", " \n", + " energy [MeV]\n", + " cell\n", " nuclide\n", " score\n", " mean\n", @@ -957,24 +960,28 @@ " \n", " \n", " \n", + " \n", + " \n", " \n", " \n", " \n", " \n", " 0\n", + " 0.0e+00 - 6.2e-01\n", + " 10000\n", " total\n", " absorption\n", - " 0.769263\n", - " 0.004172\n", + " 0.802094\n", + " 0.004432\n", " \n", " \n", "\n", "" ], "text/plain": [ - " nuclide score mean std. dev.\n", - "bin \n", - "0 total absorption 0.769263 0.004172" + " energy [MeV] cell nuclide score mean std. dev.\n", + "bin \n", + "0 0.0e+00 - 6.2e-01 10000 total absorption 0.802094 0.004432" ] }, "execution_count": 29, @@ -985,7 +992,7 @@ "source": [ "# Compute thermal flux utilization factor using tally arithmetic\n", "fuel_therm_abs_rate = sp.get_tally(name='fuel therm. abs. rate')\n", - "therm_util = fuel_therm_abs_rate / abs_rate\n", + "therm_util = fuel_therm_abs_rate / therm_abs_rate\n", "therm_util.get_pandas_dataframe()" ] }, From d9c6bcb887c0fc349cb1c11afce74a4638f5f564 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Mon, 10 Aug 2015 13:52:41 +0700 Subject: [PATCH 10/43] Add last factor of four-factor formula to arithmetic notebook --- .../pythonapi/examples/tally-arithmetic.ipynb | 148 +++++++++++++----- 1 file changed, 109 insertions(+), 39 deletions(-) diff --git a/docs/source/pythonapi/examples/tally-arithmetic.ipynb b/docs/source/pythonapi/examples/tally-arithmetic.ipynb index 9d2a81493..acadc4c4b 100644 --- a/docs/source/pythonapi/examples/tally-arithmetic.ipynb +++ b/docs/source/pythonapi/examples/tally-arithmetic.ipynb @@ -495,12 +495,9 @@ "source": [ "# Fast Fission Factor tallies\n", "therm_fiss_rate = openmc.Tally(name='therm. fiss. rate')\n", - "tot_fiss_rate = openmc.Tally(name='tot. fiss. rate')\n", - "therm_fiss_rate.add_score('fission')\n", - "tot_fiss_rate.add_score('fission')\n", + "therm_fiss_rate.add_score('nu-fission')\n", "therm_fiss_rate.add_filter(openmc.Filter(type='energy', bins=[0., 0.625]))\n", - "tallies_file.add_tally(therm_fiss_rate)\n", - "tallies_file.add_tally(tot_fiss_rate)" + "tallies_file.add_tally(therm_fiss_rate)" ] }, { @@ -572,7 +569,7 @@ " Copyright: 2011-2015 Massachusetts Institute of Technology\n", " License: http://mit-crpg.github.io/openmc/license.html\n", " Version: 0.6.2\n", - " Date/Time: 2015-08-10 13:21:32\n", + " Date/Time: 2015-08-10 13:51:02\n", " MPI Processes: 4\n", "\n", " ===========================================================================\n", @@ -628,20 +625,20 @@ "\n", " =======================> TIMING STATISTICS <=======================\n", "\n", - " Total time for initialization = 1.4260E+00 seconds\n", - " Reading cross sections = 3.8800E-01 seconds\n", - " Total time in simulation = 9.0700E+00 seconds\n", - " Time in transport only = 8.3270E+00 seconds\n", - " Time in inactive batches = 1.4110E+00 seconds\n", - " Time in active batches = 7.6590E+00 seconds\n", - " Time synchronizing fission bank = 6.7300E-01 seconds\n", - " Sampling source sites = 1.1000E-02 seconds\n", - " SEND/RECV source sites = 2.0000E-03 seconds\n", - " Time accumulating tallies = 1.0000E-03 seconds\n", + " Total time for initialization = 1.0760E+00 seconds\n", + " Reading cross sections = 3.6600E-01 seconds\n", + " Total time in simulation = 1.0001E+01 seconds\n", + " Time in transport only = 9.0020E+00 seconds\n", + " Time in inactive batches = 1.7190E+00 seconds\n", + " Time in active batches = 8.2820E+00 seconds\n", + " Time synchronizing fission bank = 8.8400E-01 seconds\n", + " Sampling source sites = 3.7000E-02 seconds\n", + " SEND/RECV source sites = 0.0000E+00 seconds\n", + " Time accumulating tallies = 1.6000E-02 seconds\n", " Total time for finalization = 2.0000E-03 seconds\n", - " Total time elapsed = 1.0500E+01 seconds\n", - " Calculation Rate (inactive) = 8858.97 neutrons/second\n", - " Calculation Rate (active) = 4896.20 neutrons/second\n", + " Total time elapsed = 1.1089E+01 seconds\n", + " Calculation Rate (inactive) = 7271.67 neutrons/second\n", + " Calculation Rate (active) = 4527.89 neutrons/second\n", "\n", " ============================> RESULTS <============================\n", "\n", @@ -795,7 +792,7 @@ "source": [ "Notice that even though the neutron production rate and absorption rate are separate tallies, we still get a first-order estimate of the uncertainty on the quotient of them automatically!\n", "\n", - "Now, let's analyze of few of the classic factors in the four-factor formula, starting with the resonance escape probability, which we'll define as $$p=\\frac{\\langle\\Sigma_a\\phi\\rangle_T}{\\langle\\Sigma_a\\phi\\rangle}$$ where the subscript $T$ means thermal energies." + "Now, let's analyze the classic factors in the four-factor formula, starting with the resonance escape probability, which we'll define as $$p=\\frac{\\langle\\Sigma_a\\phi\\rangle_T}{\\langle\\Sigma_a\\phi\\rangle}$$ where the subscript $T$ means thermal energies." ] }, { @@ -861,7 +858,7 @@ "metadata": {}, "source": [ "The fast fission factor can be calculated as\n", - "$$\\epsilon=\\frac{\\langle\\Sigma_f\\phi\\rangle}{\\langle\\Sigma_f\\phi\\rangle_T}$$" + "$$\\epsilon=\\frac{\\langle\\nu\\Sigma_f\\phi\\rangle}{\\langle\\nu\\Sigma_f\\phi\\rangle_T}$$" ] }, { @@ -896,18 +893,18 @@ " \n", " 0\n", " total\n", - " fission\n", - " 1.080124\n", - " 0.008126\n", + " nu-fission\n", + " 1.09144\n", + " 0.008201\n", " \n", " \n", "\n", "" ], "text/plain": [ - " nuclide score mean std. dev.\n", - "bin \n", - "0 total fission 1.080124 0.008126" + " nuclide score mean std. dev.\n", + "bin \n", + "0 total nu-fission 1.09144 0.008201" ] }, "execution_count": 28, @@ -918,8 +915,7 @@ "source": [ "# Compute fast fission factor factor using tally arithmetic\n", "therm_fiss_rate = sp.get_tally(name='therm. fiss. rate')\n", - "tot_fiss_rate = sp.get_tally(name='tot. fiss. rate')\n", - "fast_fiss = tot_fiss_rate / therm_fiss_rate\n", + "fast_fiss = fiss_rate / therm_fiss_rate\n", "fast_fiss.get_pandas_dataframe()" ] }, @@ -1000,12 +996,86 @@ "cell_type": "markdown", "metadata": {}, "source": [ - "Let's move on to a more complicated example now. Before we set up tallies to get reaction rates in the fuel and moderator in two energy groups for two different nuclides. We can use tally arithmetic to divide each of these reaction rates by the flux to get microscopic multi-group cross sections." + "The final factor is the number of fission neutrons produced per absorption in fuel, calculated as $$\\eta = \\frac{\\langle \\nu\\Sigma_f\\phi \\rangle_T}{\\langle \\Sigma_a \\phi \\rangle^F_T}$$" ] }, { "cell_type": "code", "execution_count": 30, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
\n", + "\n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + " \n", + "
energy [MeV]cellnuclidescoremeanstd. dev.
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00.0e+00 - 6.2e-0110000total(nu-fission / absorption)1.2411030.008414
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" + ], + "text/plain": [ + " energy [MeV] cell nuclide score mean \\\n", + "bin \n", + "0 0.0e+00 - 6.2e-01 10000 total (nu-fission / absorption) 1.241103 \n", + "\n", + " std. dev. \n", + "bin \n", + "0 0.008414 " + ] + }, + "execution_count": 30, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "# Compute neutrons produced per absorption (eta) using tally arithmetic\n", + "eta = therm_fiss_rate / fuel_therm_abs_rate\n", + "eta.get_pandas_dataframe()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "Let's move on to a more complicated example now. Before we set up tallies to get reaction rates in the fuel and moderator in two energy groups for two different nuclides. We can use tally arithmetic to divide each of these reaction rates by the flux to get microscopic multi-group cross sections." + ] + }, + { + "cell_type": "code", + "execution_count": 31, "metadata": { "collapsed": false, "scrolled": true @@ -1021,7 +1091,7 @@ }, { "cell_type": "code", - "execution_count": 31, + "execution_count": 32, "metadata": { "collapsed": false }, @@ -1152,7 +1222,7 @@ "7 1.274353e-05 " ] }, - "execution_count": 31, + "execution_count": 32, "metadata": {}, "output_type": "execute_result" } @@ -1171,7 +1241,7 @@ }, { "cell_type": "code", - "execution_count": 32, + "execution_count": 33, "metadata": { "collapsed": false }, @@ -1203,7 +1273,7 @@ }, { "cell_type": "code", - "execution_count": 33, + "execution_count": 34, "metadata": { "collapsed": false }, @@ -1227,7 +1297,7 @@ }, { "cell_type": "code", - "execution_count": 34, + "execution_count": 35, "metadata": { "collapsed": false }, @@ -1258,7 +1328,7 @@ }, { "cell_type": "code", - "execution_count": 35, + "execution_count": 36, "metadata": { "collapsed": false }, @@ -1338,7 +1408,7 @@ "3 10000 6.3e-07 - 2.0e+01 U-235 nu-fission 0.093265 4.590785e-04" ] }, - "execution_count": 35, + "execution_count": 36, "metadata": {}, "output_type": "execute_result" } @@ -1351,7 +1421,7 @@ }, { "cell_type": "code", - "execution_count": 36, + "execution_count": 37, "metadata": { "collapsed": false }, @@ -1481,7 +1551,7 @@ "8 10002 1.9e+00 - 2.0e+01 H-1 scatter 0.377400 0.004341" ] }, - "execution_count": 36, + "execution_count": 37, "metadata": {}, "output_type": "execute_result" } From 788e03b208fd170b690d0c78daaecdf2289c53a8 Mon Sep 17 00:00:00 2001 From: Will Boyd Date: Mon, 10 Aug 2015 19:10:01 -0700 Subject: [PATCH 11/43] Fixed filter indexing issue in Tally.get_values(...) introduced in #426 --- openmc/tallies.py | 3 ++- 1 file changed, 2 insertions(+), 1 deletion(-) diff --git a/openmc/tallies.py b/openmc/tallies.py index fa41f5c7f..4108b0932 100644 --- a/openmc/tallies.py +++ b/openmc/tallies.py @@ -914,7 +914,8 @@ class Tally(object): filter_indices[i][j] = filter_index # Account for stride in each of the previous filters - filter_indices[:i] *= filter.num_bins + for indices in filter_indices[:i]: + indices *= filter.num_bins # Apply outer product sum between all filter bin indices filter_indices = list(map(sum, itertools.product(*filter_indices))) From ff49e1de372a1dc2e7733cd83c0035004c8404ee Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Tue, 11 Aug 2015 13:42:36 +0700 Subject: [PATCH 12/43] Re-run pandas-dataframe notebook after bug fix --- .../examples/pandas-dataframes.ipynb | 64 ++++++------------- 1 file changed, 20 insertions(+), 44 deletions(-) diff --git a/docs/source/pythonapi/examples/pandas-dataframes.ipynb b/docs/source/pythonapi/examples/pandas-dataframes.ipynb index 6d7dff9c1..24c5c00a0 100644 --- a/docs/source/pythonapi/examples/pandas-dataframes.ipynb +++ b/docs/source/pythonapi/examples/pandas-dataframes.ipynb @@ -563,7 +563,7 @@ " Copyright: 2011-2015 Massachusetts Institute of Technology\n", " License: http://mit-crpg.github.io/openmc/license.html\n", " Version: 0.6.2\n", - " Date/Time: 2015-08-10 06:49:48\n", + " Date/Time: 2015-08-11 13:40:43\n", " MPI Processes: 4\n", "\n", " ===========================================================================\n", @@ -630,20 +630,20 @@ "\n", " =======================> TIMING STATISTICS <=======================\n", "\n", - " Total time for initialization = 9.4100E-01 seconds\n", - " Reading cross sections = 2.9400E-01 seconds\n", - " Total time in simulation = 7.4740E+00 seconds\n", - " Time in transport only = 6.3910E+00 seconds\n", - " Time in inactive batches = 8.9600E-01 seconds\n", - " Time in active batches = 6.5780E+00 seconds\n", - " Time synchronizing fission bank = 9.9000E-01 seconds\n", - " Sampling source sites = 4.7000E-02 seconds\n", + " Total time for initialization = 9.7300E-01 seconds\n", + " Reading cross sections = 3.0300E-01 seconds\n", + " Total time in simulation = 5.9130E+00 seconds\n", + " Time in transport only = 5.4000E+00 seconds\n", + " Time in inactive batches = 7.7300E-01 seconds\n", + " Time in active batches = 5.1400E+00 seconds\n", + " Time synchronizing fission bank = 4.4600E-01 seconds\n", + " Sampling source sites = 0.0000E+00 seconds\n", " SEND/RECV source sites = 0.0000E+00 seconds\n", - " Time accumulating tallies = 6.0000E-03 seconds\n", + " Time accumulating tallies = 9.0000E-03 seconds\n", " Total time for finalization = 0.0000E+00 seconds\n", - " Total time elapsed = 8.4190E+00 seconds\n", - " Calculation Rate (inactive) = 13950.9 neutrons/second\n", - " Calculation Rate (active) = 5700.82 neutrons/second\n", + " Total time elapsed = 6.8870E+00 seconds\n", + " Calculation Rate (inactive) = 16170.8 neutrons/second\n", + " Calculation Rate (active) = 7295.72 neutrons/second\n", "\n", " ============================> RESULTS <============================\n", "\n", @@ -772,34 +772,10 @@ "text": [ "[[[ 0.14583021]]\n", "\n", - " [[ 0.07919847]]\n", - "\n", - " [[ 0.22707514]]\n", - "\n", - " [[ 0.07537836]]\n", - "\n", - " [[ 0.07919847]]\n", - "\n", " [[ 0.07846909]]\n", "\n", - " [[ 0.07537836]]\n", - "\n", - " [[ 0.07177901]]\n", - "\n", - " [[ 0.22707514]]\n", - "\n", - " [[ 0.07537836]]\n", - "\n", " [[ 0.33705448]]\n", "\n", - " [[ 0.177405 ]]\n", - "\n", - " [[ 0.07537836]]\n", - "\n", - " [[ 0.07177901]]\n", - "\n", - " [[ 0.177405 ]]\n", - "\n", " [[ 0.15150059]]]\n" ] } @@ -1110,7 +1086,7 @@ "data": { "image/png": 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FJ00za7/qq1HOBLojoicieoGbgLkNdc4CrgeIiAeBsZImNIuNiBUR8XhBe3OB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\nTkSuQmCC\n", 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"text/plain": [ - "" + "" ] }, "metadata": {}, From 817403ae79e8341013ab38c8ca750ad587aef3f9 Mon Sep 17 00:00:00 2001 From: Will Boyd Date: Tue, 11 Aug 2015 18:44:22 -0700 Subject: [PATCH 13/43] Now set num_score_bins attribute for derived tallies in arithmetic operations --- openmc/tallies.py | 8 +++++++- 1 file changed, 7 insertions(+), 1 deletion(-) diff --git a/openmc/tallies.py b/openmc/tallies.py index 4108b0932..783768149 100644 --- a/openmc/tallies.py +++ b/openmc/tallies.py @@ -1471,6 +1471,7 @@ class Tally(object): new_name = '({0} {1} {2})'.format(self.name, binary_op, other.name) new_tally = Tally(name=new_name) new_tally.with_batch_statistics = True + new_tally._derived = True data = self._align_tally_data(other) @@ -1498,7 +1499,7 @@ class Tally(object): new_tally._std_dev = np.abs(new_tally.mean) * \ np.sqrt(self_rel_err**2 + other_rel_err**2) elif binary_op == '^': - data = self._align_tally_data(power) + data = self._align_tally_data(other) mean_ratio = data['other']['mean'] / data['self']['mean'] first_term = mean_ratio * data['self']['std. dev.'] second_term = \ @@ -1513,6 +1514,7 @@ class Tally(object): new_tally.with_summary = self.with_summary if self.num_realizations == other.num_realizations: new_tally.num_realizations = self.num_realizations + new_tally.num_score_bins = self.num_score_bins * other.num_score_bins # Generate filter "outer products" if self.filters == other.filters: @@ -1740,6 +1742,7 @@ class Tally(object): new_tally = self._outer_product(other, binary_op='-') elif isinstance(other, Real): + new_tally = Tally(name='derived') new_tally.name = self.name new_tally._mean = self._mean - other new_tally._std_dev = self._std_dev @@ -1808,6 +1811,7 @@ class Tally(object): new_tally = self._outer_product(other, binary_op='*') elif isinstance(other, Real): + new_tally = Tally(name='derived') new_tally.name = self.name new_tally._mean = self._mean * other new_tally._std_dev = self._std_dev * np.abs(other) @@ -1876,6 +1880,7 @@ class Tally(object): new_tally = self._outer_product(other, binary_op='/') elif isinstance(other, Real): + new_tally = Tally(name='derived') new_tally.name = self.name new_tally._mean = self._mean / other new_tally._std_dev = self._std_dev * np.abs(1. / other) @@ -1944,6 +1949,7 @@ class Tally(object): new_tally = self._outer_product(power, binary_op='^') elif isinstance(power, Real): + new_tally = Tally(name='derived') new_tally.name = self.name new_tally._mean = self._mean ** power self_rel_err = self.std_dev / self.mean From 0a024c8dd7b8846911e4f5698ad1b54def3e4fd3 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Wed, 12 Aug 2015 09:06:06 +0700 Subject: [PATCH 14/43] Calculate k-infinity from four factors in tally-arithmetic notebook --- .../pythonapi/examples/tally-arithmetic.ipynb | 117 ++++++++++++++---- 1 file changed, 93 insertions(+), 24 deletions(-) diff --git a/docs/source/pythonapi/examples/tally-arithmetic.ipynb b/docs/source/pythonapi/examples/tally-arithmetic.ipynb index acadc4c4b..a2930a80b 100644 --- a/docs/source/pythonapi/examples/tally-arithmetic.ipynb +++ b/docs/source/pythonapi/examples/tally-arithmetic.ipynb @@ -569,7 +569,7 @@ " Copyright: 2011-2015 Massachusetts Institute of Technology\n", " License: http://mit-crpg.github.io/openmc/license.html\n", " Version: 0.6.2\n", - " Date/Time: 2015-08-10 13:51:02\n", + " Date/Time: 2015-08-12 08:58:22\n", " MPI Processes: 4\n", "\n", " ===========================================================================\n", @@ -625,20 +625,20 @@ "\n", " =======================> TIMING STATISTICS <=======================\n", "\n", - " Total time for initialization = 1.0760E+00 seconds\n", - " Reading cross sections = 3.6600E-01 seconds\n", - " Total time in simulation = 1.0001E+01 seconds\n", - " Time in transport only = 9.0020E+00 seconds\n", - " Time in inactive batches = 1.7190E+00 seconds\n", - " Time in active batches = 8.2820E+00 seconds\n", - " Time synchronizing fission bank = 8.8400E-01 seconds\n", - " Sampling source sites = 3.7000E-02 seconds\n", + " Total time for initialization = 9.7500E-01 seconds\n", + " Reading cross sections = 2.8800E-01 seconds\n", + " Total time in simulation = 8.2720E+00 seconds\n", + " Time in transport only = 7.8820E+00 seconds\n", + " Time in inactive batches = 1.0260E+00 seconds\n", + " Time in active batches = 7.2460E+00 seconds\n", + " Time synchronizing fission bank = 1.9500E-01 seconds\n", + " Sampling source sites = 2.0000E-03 seconds\n", " SEND/RECV source sites = 0.0000E+00 seconds\n", - " Time accumulating tallies = 1.6000E-02 seconds\n", + " Time accumulating tallies = 0.0000E+00 seconds\n", " Total time for finalization = 2.0000E-03 seconds\n", - " Total time elapsed = 1.1089E+01 seconds\n", - " Calculation Rate (inactive) = 7271.67 neutrons/second\n", - " Calculation Rate (active) = 4527.89 neutrons/second\n", + " Total time elapsed = 9.2580E+00 seconds\n", + " Calculation Rate (inactive) = 12183.2 neutrons/second\n", + " Calculation Rate (active) = 5175.27 neutrons/second\n", "\n", " ============================> RESULTS <============================\n", "\n", @@ -792,7 +792,7 @@ "source": [ "Notice that even though the neutron production rate and absorption rate are separate tallies, we still get a first-order estimate of the uncertainty on the quotient of them automatically!\n", "\n", - "Now, let's analyze the classic factors in the four-factor formula, starting with the resonance escape probability, which we'll define as $$p=\\frac{\\langle\\Sigma_a\\phi\\rangle_T}{\\langle\\Sigma_a\\phi\\rangle}$$ where the subscript $T$ means thermal energies." + "Often in textbooks you'll see k-infinity represented using the four-factor formula $$k_\\infty = p \\epsilon f \\eta.$$ Let's analyze each of these factors, starting with the resonance escape probability which is defined as $$p=\\frac{\\langle\\Sigma_a\\phi\\rangle_T}{\\langle\\Sigma_a\\phi\\rangle}$$ where the subscript $T$ means thermal energies." ] }, { @@ -1070,12 +1070,81 @@ "cell_type": "markdown", "metadata": {}, "source": [ - "Let's move on to a more complicated example now. Before we set up tallies to get reaction rates in the fuel and moderator in two energy groups for two different nuclides. We can use tally arithmetic to divide each of these reaction rates by the flux to get microscopic multi-group cross sections." + "Now we can calculate $k_\\infty$ using the product of the factors form the four-factor formula." ] }, { "cell_type": "code", "execution_count": 31, + "metadata": { + "collapsed": false + }, + "outputs": [ + { + "data": { + "text/html": [ + "
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nuclidescoremeanstd. dev.
bin
0total(((absorption * nu-fission) * absorption) * (n...1.0420350.013263
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" + ], + "text/plain": [ + " nuclide score mean \\\n", + "bin \n", + "0 total (((absorption * nu-fission) * absorption) * (n... 1.042035 \n", + "\n", + " std. dev. \n", + "bin \n", + "0 0.013263 " + ] + }, + "execution_count": 31, + "metadata": {}, + "output_type": "execute_result" + } + ], + "source": [ + "keff = res_esc * fast_fiss * therm_util * eta\n", + "keff.get_pandas_dataframe()" + ] + }, + { + "cell_type": "markdown", + "metadata": {}, + "source": [ + "We see that the value we've obtained here has exactly the same mean as before. However, because of the way it was calculated, the standard deviation appears to be larger.\n", + "\n", + "Let's move on to a more complicated example now. Before we set up tallies to get reaction rates in the fuel and moderator in two energy groups for two different nuclides. We can use tally arithmetic to divide each of these reaction rates by the flux to get microscopic multi-group cross sections." + ] + }, + { + "cell_type": "code", + "execution_count": 32, "metadata": { "collapsed": false, "scrolled": true @@ -1091,7 +1160,7 @@ }, { "cell_type": "code", - "execution_count": 32, + "execution_count": 33, "metadata": { "collapsed": false }, @@ -1222,7 +1291,7 @@ "7 1.274353e-05 " ] }, - "execution_count": 32, + "execution_count": 33, "metadata": {}, "output_type": "execute_result" } @@ -1241,7 +1310,7 @@ }, { "cell_type": "code", - "execution_count": 33, + "execution_count": 34, "metadata": { "collapsed": false }, @@ -1273,7 +1342,7 @@ }, { "cell_type": "code", - "execution_count": 34, + "execution_count": 35, "metadata": { "collapsed": false }, @@ -1297,7 +1366,7 @@ }, { "cell_type": "code", - "execution_count": 35, + "execution_count": 36, "metadata": { "collapsed": false }, @@ -1328,7 +1397,7 @@ }, { "cell_type": "code", - "execution_count": 36, + "execution_count": 37, "metadata": { "collapsed": false }, @@ -1408,7 +1477,7 @@ "3 10000 6.3e-07 - 2.0e+01 U-235 nu-fission 0.093265 4.590785e-04" ] }, - "execution_count": 36, + "execution_count": 37, "metadata": {}, "output_type": "execute_result" } @@ -1421,7 +1490,7 @@ }, { "cell_type": "code", - "execution_count": 37, + "execution_count": 38, "metadata": { "collapsed": false }, @@ -1551,7 +1620,7 @@ "8 10002 1.9e+00 - 2.0e+01 H-1 scatter 0.377400 0.004341" ] }, - "execution_count": 37, + "execution_count": 38, "metadata": {}, "output_type": "execute_result" } From ff69982fe0c3cc4d8c4bffb0abbc835b34e467b2 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Tue, 4 Aug 2015 10:57:45 +1000 Subject: [PATCH 15/43] Started adding release notes for version 0.7.0 --- docs/source/index.rst | 2 +- docs/source/releasenotes.rst | 67 ++++++++++++++++++++++++ docs/source/releasenotes/index.rst | 25 --------- docs/source/releasenotes/notes_0.4.0.rst | 36 ------------- docs/source/releasenotes/notes_0.4.1.rst | 55 ------------------- docs/source/releasenotes/notes_0.4.2.rst | 56 -------------------- docs/source/releasenotes/notes_0.4.3.rst | 53 ------------------- docs/source/releasenotes/notes_0.4.4.rst | 45 ---------------- docs/source/releasenotes/notes_0.5.0.rst | 52 ------------------ docs/source/releasenotes/notes_0.5.1.rst | 45 ---------------- docs/source/releasenotes/notes_0.5.2.rst | 57 -------------------- docs/source/releasenotes/notes_0.5.3.rst | 49 ----------------- docs/source/releasenotes/notes_0.5.4.rst | 64 ---------------------- docs/source/releasenotes/notes_0.6.0.rst | 59 --------------------- docs/source/releasenotes/notes_0.6.1.rst | 65 ----------------------- docs/source/releasenotes/notes_0.6.2.rst | 58 -------------------- 16 files changed, 68 insertions(+), 720 deletions(-) create mode 100644 docs/source/releasenotes.rst delete mode 100644 docs/source/releasenotes/index.rst delete mode 100644 docs/source/releasenotes/notes_0.4.0.rst delete mode 100644 docs/source/releasenotes/notes_0.4.1.rst delete mode 100644 docs/source/releasenotes/notes_0.4.2.rst delete mode 100644 docs/source/releasenotes/notes_0.4.3.rst delete mode 100644 docs/source/releasenotes/notes_0.4.4.rst delete mode 100644 docs/source/releasenotes/notes_0.5.0.rst delete mode 100644 docs/source/releasenotes/notes_0.5.1.rst delete mode 100644 docs/source/releasenotes/notes_0.5.2.rst delete mode 100644 docs/source/releasenotes/notes_0.5.3.rst delete mode 100644 docs/source/releasenotes/notes_0.5.4.rst delete mode 100644 docs/source/releasenotes/notes_0.6.0.rst delete mode 100644 docs/source/releasenotes/notes_0.6.1.rst delete mode 100644 docs/source/releasenotes/notes_0.6.2.rst diff --git a/docs/source/index.rst b/docs/source/index.rst index 02eb1f6d9..8dba92016 100644 --- a/docs/source/index.rst +++ b/docs/source/index.rst @@ -28,7 +28,7 @@ free to send a message to the User's Group `mailing list`_. :maxdepth: 1 quickinstall - releasenotes/index + releasenotes methods/index usersguide/index devguide/index diff --git a/docs/source/releasenotes.rst b/docs/source/releasenotes.rst new file mode 100644 index 000000000..dffc17201 --- /dev/null +++ b/docs/source/releasenotes.rst @@ -0,0 +1,67 @@ +.. _releasenotes: + +============================== +Release Notes for OpenMC 0.7.0 +============================== + +------------------- +System Requirements +------------------- + +There are no special requirements for running the OpenMC code. As of this +release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, +and Microsoft Windows 7. Memory requirements will vary depending on the size of +the problem at hand (mostly on the number of nuclides in the problem). + +------------ +New Features +------------ + +- Complete Python API +- Python 3 compatability for all scripts +- All scripts consistently named openmc-* and installed together +- New 'distribcell' tally filter for repeated cells +- Ability to specify outer lattice universe +- XML input validation utility (openmc-validate-xml) +- Support for hexagonal lattices +- Material union energy grid method +- Tally triggers +- Remove dependence on PETSc +- Significant OpenMP performance improvements +- Support for Fortran 2008 MPI interface +- Use of Travis CI for continuous integration +- Simplifications and improvements to test suite + +--------- +Bug Fixes +--------- + +- b5f712_: Fix bug in spherical harmonics tallies +- e6675b_: Ensure all constants are double precision +- 04e2c1_: Fix potential bug in sample_nuclide routine +- 6121d9_: Fix bugs related to particle track files +- 2f0e89_: Fixes for nuclide specification in tallies + +.. _b5f712: https://github.com/mit-crpg/openmc/commit/b5f712 +.. _e6675b: https://github.com/mit-crpg/openmc/commit/e6675b +.. _04e2c1: https://github.com/mit-crpg/openmc/commit/04e2c1 +.. _6121d9: https://github.com/mit-crpg/openmc/commit/6121d9 +.. _2f0e89: https://github.com/mit-crpg/openmc/commit/2f0e89 + +------------ +Contributors +------------ + +This release contains new contributions from the following people: + +- `Will Boyd `_ +- `Matt Ellis `_ +- `Sterling Harper `_ +- `Bryan Herman `_ +- `Nicholas Horelik `_ +- `Colin Josey `_ +- `William Lyu `_ +- `Adam Nelson `_ +- `Paul Romano `_ +- `Anthony Scopatz `_ +- `Jon Walsh `_ diff --git a/docs/source/releasenotes/index.rst b/docs/source/releasenotes/index.rst deleted file mode 100644 index 556cf518a..000000000 --- a/docs/source/releasenotes/index.rst +++ /dev/null @@ -1,25 +0,0 @@ -.. _releasenotes: - -============= -Release Notes -============= - -The release notes for OpenMC give a list of system requirements, new features, -bugs fixed, and known issues for each successive release. - -.. toctree:: - :maxdepth: 1 - - notes_0.6.2 - notes_0.6.1 - notes_0.6.0 - notes_0.5.4 - notes_0.5.3 - notes_0.5.2 - notes_0.5.1 - notes_0.5.0 - notes_0.4.4 - notes_0.4.3 - notes_0.4.2 - notes_0.4.1 - notes_0.4.0 diff --git a/docs/source/releasenotes/notes_0.4.0.rst b/docs/source/releasenotes/notes_0.4.0.rst deleted file mode 100644 index 3e0a444e3..000000000 --- a/docs/source/releasenotes/notes_0.4.0.rst +++ /dev/null @@ -1,36 +0,0 @@ -.. _notes_0.4.0: - -============================== -Release Notes for OpenMC 0.4.0 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions as well as -Mac OS X. However, it has not been tested yet on any releases of Microsoft -Windows. Memory requirements will vary depending on the size of the problem at -hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- The probability table method for treatment of energy self-shielding in the - unresolved resonance range has been implemented and is now turned on by - default. -- Calculation of Shannon entropy for assessing convergence of the fission source - distribution. -- Ability to compile with the PGI Fortran compiler. -- Ability to run on IBM BlueGene/P machines. -- Completely rewrote how nested universes are handled. Geometry is now much more - robust. - ---------- -Bug Fixes ---------- - -- Many geometry errors have been fixed. The Monte Carlo performance benchmark - can now be successfully run in OpenMC. diff --git a/docs/source/releasenotes/notes_0.4.1.rst b/docs/source/releasenotes/notes_0.4.1.rst deleted file mode 100644 index 2492f23a9..000000000 --- a/docs/source/releasenotes/notes_0.4.1.rst +++ /dev/null @@ -1,55 +0,0 @@ -.. _notes_0.4.1: - -============================== -Release Notes for OpenMC 0.4.1 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions as well as -Mac OS X. However, it has not been tested yet on any releases of Microsoft -Windows. Memory requirements will vary depending on the size of the problem at -hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- A batching method has been implemented so that statistics can be calculated - based on multiple generations instead of a single generation. This can help to - overcome problems with underpredicted variance in problems where there is - correlation between successive fission source iterations. -- Users now have the option to select a non-unionized energy grid for problems - with many nuclides where the use of a unionized grid is not feasible. -- Improved plotting capability (Nick Horelik). The plotting input is now in - ``plots.xml`` instead of ``plot.xml``. -- Added multiple estimators for k-effective and added a global tally for - leakage. -- Moved cross section-related output into cross_sections.out. -- Improved timing capabilities. -- Can now use more than 2**31 - 1 particles per generation. -- Improved fission bank synchronization method. This also necessitated changing - the source bank to be of type Bank rather than of type Particle. -- Added HDF5 output (not complete yet). -- Major changes to tally implementation. - ---------- -Bug Fixes ---------- - -- `b206a8`_: Fixed subtle error in the sampling of energy distributions. -- `800742`_: Fixed error in sampling of angle and rotating angles. -- `a07c08`_: Fixed bug in linear-linear interpolation during sampling energy. -- `a75283`_: Fixed energy and energyout tally filters to support many bins. -- `95cfac`_: Fixed error in cell neighbor searches. -- `83a803`_: Fixed bug related to probability tables. - -.. _b206a8: https://github.com/mit-crpg/openmc/commit/b206a8 -.. _800742: https://github.com/mit-crpg/openmc/commit/800742 -.. _a07c08: https://github.com/mit-crpg/openmc/commit/a07c08 -.. _a75283: https://github.com/mit-crpg/openmc/commit/a75283 -.. _95cfac: https://github.com/mit-crpg/openmc/commit/95cfac -.. _83a803: https://github.com/mit-crpg/openmc/commit/83a803 diff --git a/docs/source/releasenotes/notes_0.4.2.rst b/docs/source/releasenotes/notes_0.4.2.rst deleted file mode 100644 index 0ca5287a1..000000000 --- a/docs/source/releasenotes/notes_0.4.2.rst +++ /dev/null @@ -1,56 +0,0 @@ -.. _notes_0.4.2: - -============================== -Release Notes for OpenMC 0.4.2 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, -and Microsoft Windows 7. Memory requirements will vary depending on the size of -the problem at hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- Ability to specify void materials. -- Option to not reduce tallies across processors at end of each batch. -- Uniform fission site method for reducing variance on local tallies. -- Reading/writing binary source files. -- Added more messages for or high verbosity. -- Estimator for diffusion coefficient. -- Ability to specify 'point' source type. -- Ability to change random number seed. -- Users can now specify units='sum' on a tag. This tells the code that - the total material density is the sum of the atom fractions listed for each - nuclide on the material. - ---------- -Bug Fixes ---------- - -- a27f8f_: Fixed runtime error bug when using Intel compiler with DEBUG on. -- afe121_: Fixed minor bug in fission bank algorithms. -- e0968e_: Force re-evaluation of cross-sections when each particle is born. -- 298db8_: Fixed bug in surface currents when using energy-in filter. -- 2f3bbe_: Fixed subtle bug in S(a,b) cross section calculation. -- 671f30_: Fixed surface currents on mesh not encompassing geometry. -- b2c40e_: Fixed bug in incoming energy filter for track-length tallies. -- 5524fd_: Mesh filter now works with track-length tallies. -- d050c7_: Added Bessel's correction to make estimate of variance unbiased. -- 2a5b9c_: Fixed regression in plotting. - -.. _a27f8f: https://github.com/mit-crpg/openmc/commit/a27f8f -.. _afe121: https://github.com/mit-crpg/openmc/commit/afe121 -.. _e0968e: https://github.com/mit-crpg/openmc/commit/e0968e -.. _298db8: https://github.com/mit-crpg/openmc/commit/298db8 -.. _2f3bbe: https://github.com/mit-crpg/openmc/commit/2f3bbe -.. _671f30: https://github.com/mit-crpg/openmc/commit/671f30 -.. _b2c40e: https://github.com/mit-crpg/openmc/commit/b2c40e -.. _5524fd: https://github.com/mit-crpg/openmc/commit/5524fd -.. _d050c7: https://github.com/mit-crpg/openmc/commit/d050c7 -.. _2a5b9c: https://github.com/mit-crpg/openmc/commit/2a5b9c diff --git a/docs/source/releasenotes/notes_0.4.3.rst b/docs/source/releasenotes/notes_0.4.3.rst deleted file mode 100644 index fce7a7da3..000000000 --- a/docs/source/releasenotes/notes_0.4.3.rst +++ /dev/null @@ -1,53 +0,0 @@ -.. _notes_0.4.3: - -============================== -Release Notes for OpenMC 0.4.3 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, -and Microsoft Windows 7. Memory requirements will vary depending on the size of -the problem at hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- Option to report confidence intervals for tally results. -- Rotation and translation for filled cells. -- Ability to explicitly specify for tallies. -- Ability to store state points and use them to restart runs. -- Fixed source calculations (no subcritical multiplication however). -- Expanded options for external source distribution. -- Ability to tally reaction rates for individual nuclides within a material. -- Reduced memory usage by removing redundant storage or some cross-sections. -- 3bd35b_: Log-log interpolation for URR probability tables. -- Support to specify labels on tallies (nelsonag_). - ---------- -Bug Fixes ---------- - -- 33f29a_: Handle negative values in probability table. -- 1c472d_: Fixed survival biasing with probability tables. -- 3c6e80_: Fixed writing tallies with no filters. -- 460ef1_: Invalid results for duplicate tallies. -- 0069d5_: Fixed bug with 0 inactive batches. -- 7af2cf_: Fixed bug in score_analog_tallies. -- 85a60e_: Pick closest angular distribution for law 61. -- 3212f5_: Fixed issue with blank line at beginning of XML files. - -.. _nelsonag: https://github.com/nelsonag -.. _33f29a: https://github.com/mit-crpg/openmc/commit/33f29a -.. _1c472d: https://github.com/mit-crpg/openmc/commit/1c472d -.. _3c6e80: https://github.com/mit-crpg/openmc/commit/3c6e80 -.. _3bd35b: https://github.com/mit-crpg/openmc/commit/3bd35b -.. _0069d5: https://github.com/mit-crpg/openmc/commit/0069d5 -.. _7af2cf: https://github.com/mit-crpg/openmc/commit/7af2cf -.. _460ef1: https://github.com/mit-crpg/openmc/commit/460ef1 -.. _85a60e: https://github.com/mit-crpg/openmc/commit/85a60e -.. _3212f5: https://github.com/mit-crpg/openmc/commit/3212f5 diff --git a/docs/source/releasenotes/notes_0.4.4.rst b/docs/source/releasenotes/notes_0.4.4.rst deleted file mode 100644 index 55a0c3f6f..000000000 --- a/docs/source/releasenotes/notes_0.4.4.rst +++ /dev/null @@ -1,45 +0,0 @@ -.. _notes_0.4.4: - -============================== -Release Notes for OpenMC 0.4.4 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, -and Microsoft Windows 7. Memory requirements will vary depending on the size of -the problem at hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- Ability to write state points when using . -- Real-time XML validation in GNU Emacs with RELAX NG schemata. -- Writing state points every n batches with -- Suppress creation of summary.out and cross_sections.out by default with option - to turn them on with tag in settings.xml file. -- Ability to create HDF5 state points. -- Binary source file is now part of state point file by default. -- Enhanced state point usage and added state point Python scripts. -- Turning confidence intervals on affects k-effective. -- Option to specify for tally meshes. - ---------- -Bug Fixes ---------- - -- 4654ee_: Fixed plotting with void cells. -- 7ee461_: Fixed bug with multi-line input using type='word'. -- 792eb3_: Fixed degrees of freedom for confidence intervals. -- 7fd617_: Fixed bug with restart runs in parallel. -- dc4a8f_: Fixed bug with fixed source restart runs. - -.. _4654ee: https://github.com/mit-crpg/openmc/commit/4654ee -.. _7ee461: https://github.com/mit-crpg/openmc/commit/7ee461 -.. _792eb3: https://github.com/mit-crpg/openmc/commit/792eb3 -.. _7fd617: https://github.com/mit-crpg/openmc/commit/7fd617 -.. _dc4a8f: https://github.com/mit-crpg/openmc/commit/dc4a8f diff --git a/docs/source/releasenotes/notes_0.5.0.rst b/docs/source/releasenotes/notes_0.5.0.rst deleted file mode 100644 index 16be1b063..000000000 --- a/docs/source/releasenotes/notes_0.5.0.rst +++ /dev/null @@ -1,52 +0,0 @@ -.. _notes_0.5.0: - -============================== -Release Notes for OpenMC 0.5.0 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, -and Microsoft Windows 7. Memory requirements will vary depending on the size of -the problem at hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- All user input options that formerly accepted "off" or "on" should now be - "false" or "true" (the proper XML schema datatype). -- The element is deprecated and was replaced with . -- Added 'events' score that returns number of events that scored to a tally. -- Restructured tally filter implementation and user input. -- Source convergence acceleration via CMFD (implemented with PETSc). -- Ability to read source files in parallel when number of particles is greater - than that number of source sites. -- Cone surface types. - ---------- -Bug Fixes ---------- - -- 737b90_: Coincident surfaces from separate universes / particle traveling - tangent to a surface. -- a819b4_: Output of surface neighbors in summary.out file. -- b11696_: Reading long attribute lists in XML input. -- 2bd46a_: Search for tallying nuclides when no default_xs specified. -- 7a1f08_: Fix word wrapping when writing messages. -- c0e3ec_: Prevent underflow when compiling with MPI=yes and DEBUG=yes. -- 6f8d9d_: Set default tally labels. -- 6a3a5e_: Fix problem with corner-crossing in lattices. - -.. _737b90: https://github.com/mit-crpg/openmc/commit/737b90 -.. _a819b4: https://github.com/mit-crpg/openmc/commit/a819b4 -.. _b11696: https://github.com/mit-crpg/openmc/commit/b11696 -.. _2bd46a: https://github.com/mit-crpg/openmc/commit/2bd46a -.. _7a1f08: https://github.com/mit-crpg/openmc/commit/7a1f08 -.. _c0e3ec: https://github.com/mit-crpg/openmc/commit/c0e3ec -.. _6f8d9d: https://github.com/mit-crpg/openmc/commit/6f8d9d -.. _6a3a5e: https://github.com/mit-crpg/openmc/commit/6a3a5e - diff --git a/docs/source/releasenotes/notes_0.5.1.rst b/docs/source/releasenotes/notes_0.5.1.rst deleted file mode 100644 index 9ba85d304..000000000 --- a/docs/source/releasenotes/notes_0.5.1.rst +++ /dev/null @@ -1,45 +0,0 @@ -.. _notes_0.5.1: - -============================== -Release Notes for OpenMC 0.5.1 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, -and Microsoft Windows 7. Memory requirements will vary depending on the size of -the problem at hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- Absorption and combined estimators for k-effective. -- Natural elements can now be specified in materials using rather than - . -- Support for multiple S(a,b) tables in a single material (e.g. BeO). -- Test suite using Python nosetests. -- Proper install capability with 'make install'. -- Lattices can now be 2 or 3 dimensions. -- New scatter-PN score type. -- New kappa-fission score type. -- Ability to tally any reaction by specifying MT. - ---------- -Bug Fixes ---------- - -- 94103e_: Two checks for outgoing energy filters. -- e77059_: Fix reaction name for MT=849. -- b0fe88_: Fix distance to surface for cones. -- 63bfd2_: Fix tracklength tallies with cell filter and universes. -- 88daf7_: Fix analog tallies with survival biasing. - -.. _94103e: https://github.com/mit-crpg/openmc/commit/94103e -.. _e77059: https://github.com/mit-crpg/openmc/commit/e77059 -.. _b0fe88: https://github.com/mit-crpg/openmc/commit/b0fe88 -.. _63bfd2: https://github.com/mit-crpg/openmc/commit/63bfd2 -.. _88daf7: https://github.com/mit-crpg/openmc/commit/88daf7 diff --git a/docs/source/releasenotes/notes_0.5.2.rst b/docs/source/releasenotes/notes_0.5.2.rst deleted file mode 100644 index d030615db..000000000 --- a/docs/source/releasenotes/notes_0.5.2.rst +++ /dev/null @@ -1,57 +0,0 @@ -.. _notes_0.5.2: - -============================== -Release Notes for OpenMC 0.5.2 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, -and Microsoft Windows 7. Memory requirements will vary depending on the size of -the problem at hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- Python script for mesh tally plotting -- Isotopic abundances based on IUPAC 2009 when using -- Particle restart files for debugging -- Code will abort after certain number of lost particles (defaults to 10) -- Region outside lattice can be filled with material (void by default) -- 3D voxel plots -- Full HDF5/PHDF5 support (including support in statepoint.py) -- Cell overlap checking with -g command line flag (or when plotting) - ---------- -Bug Fixes ---------- - -- 7632f3_: Fixed bug in statepoint.py for multiple generations per batch. -- f85ac4_: Fix infinite loop bug in error module. -- 49c36b_: Don't convert surface ids if surface filter is for current tallies. -- 5ccc78_: Fix bug in reassignment of bins for mesh filter. -- b1f52f_: Fixed bug in plot color specification. -- eae7e5_: Fixed many memory leaks. -- 10c1cc_: Minor CMFD fixes. -- afdb50_: Add compatibility for XML comments without whitespace. -- a3c593_: Fixed bug in use of free gas scattering for H-1. -- 3a66e3_: Fixed bug in 2D mesh tally implementation. -- ab0793_: Corrected PETSC_NULL references to their correct types. -- 182ebd_: Use analog estimator with energyout filter. - -.. _7632f3: https://github.com/mit-crpg/openmc/commit/7632f3 -.. _f85ac4: https://github.com/mit-crpg/openmc/commit/f85ac4 -.. _49c36b: https://github.com/mit-crpg/openmc/commit/49c36b -.. _5ccc78: https://github.com/mit-crpg/openmc/commit/5ccc78 -.. _b1f52f: https://github.com/mit-crpg/openmc/commit/b1f52f -.. _eae7e5: https://github.com/mit-crpg/openmc/commit/eae7e5 -.. _10c1cc: https://github.com/mit-crpg/openmc/commit/10c1cc -.. _afdb50: https://github.com/mit-crpg/openmc/commit/afdb50 -.. _a3c593: https://github.com/mit-crpg/openmc/commit/a3c593 -.. _3a66e3: https://github.com/mit-crpg/openmc/commit/3a66e3 -.. _ab0793: https://github.com/mit-crpg/openmc/commit/ab0793 -.. _182ebd: https://github.com/mit-crpg/openmc/commit/182ebd diff --git a/docs/source/releasenotes/notes_0.5.3.rst b/docs/source/releasenotes/notes_0.5.3.rst deleted file mode 100644 index 6d93f9aec..000000000 --- a/docs/source/releasenotes/notes_0.5.3.rst +++ /dev/null @@ -1,49 +0,0 @@ -.. _notes_0.5.3: - -============================== -Release Notes for OpenMC 0.5.3 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, -and Microsoft Windows 7. Memory requirements will vary depending on the size of -the problem at hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- Output interface enhanced to allow multiple files handles to be opened -- Particle restart file linked to output interface -- Particle restarts and state point restarts are both identified with the -r - command line flag. -- Particle instance no longer global, passed to all physics routines -- Physics routines refactored to rely less on global memory, more arguments - passed in -- CMFD routines refactored and now can compute dominance ratio on the fly -- PETSc 3.4.2 or higher must be used and compiled with fortran datatype support -- Memory leaks fixed except for ones from xml-fortran package -- Test suite enhanced to test output with different compiler options -- Description of OpenMC development workflow added -- OpenMP shared-memory parallelism added -- Special run mode --tallies removed. - ---------- -Bug Fixes ---------- - -- 2b1e8a_: Normalize direction vector after reflecting particle. -- 5853d2_: Set blank default for cross section listing alias. -- e178c7_: Fix infinite loop with words greater than 80 characters in write_message. -- c18a6e_: Check for valid secondary mode on S(a,b) tables. -- 82c456_: Fix bug where last process could have zero particles. - -.. _2b1e8a: https://github.com/mit-crpg/openmc/commit/2b1e8a -.. _5853d2: https://github.com/mit-crpg/openmc/commit/5853d2 -.. _e178c7: https://github.com/mit-crpg/openmc/commit/e178c7 -.. _c18a6e: https://github.com/mit-crpg/openmc/commit/c18a6e -.. _82c456: https://github.com/mit-crpg/openmc/commit/82c456 diff --git a/docs/source/releasenotes/notes_0.5.4.rst b/docs/source/releasenotes/notes_0.5.4.rst deleted file mode 100644 index a69354aa0..000000000 --- a/docs/source/releasenotes/notes_0.5.4.rst +++ /dev/null @@ -1,64 +0,0 @@ -.. _notes_0.5.4: - -============================== -Release Notes for OpenMC 0.5.4 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, -and Microsoft Windows 7. Memory requirements will vary depending on the size of -the problem at hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- Source sites outside geometry are resampled -- XML-Fortran backend replaced by FoX XML -- Ability to write particle track files -- Handle lost particles more gracefully (via particle track files) -- Multiple random number generator streams -- Mesh tally plotting utility converted to use Tkinter rather than PyQt -- Script added to download ACE data from NNDC -- Mixed ASCII/binary cross_sections.xml now allowed -- Expanded options for writing source bank -- Re-enabled ability to use source file as starting source -- S(a,b) recalculation avoided when same nuclide and S(a,b) table are accessed - ---------- -Bug Fixes ---------- - -- 32c03c_: Check for valid data in cross_sections.xml -- c71ef5_: Fix bug in statepoint.py -- 8884fb_: Check for all ZAIDs for S(a,b) tables -- b38af0_: Fix XML reading on multiple levels of input -- d28750_: Fix bug in convert_xsdir.py -- cf567c_: ENDF/B-VI data checked for compatibility -- 6b9461_: Fix p_valid sampling inside of sample_energy - -.. _32c03c: https://github.com/mit-crpg/openmc/commit/32c03c -.. _c71ef5: https://github.com/mit-crpg/openmc/commit/c71ef5 -.. _8884fb: https://github.com/mit-crpg/openmc/commit/8884fb -.. _b38af0: https://github.com/mit-crpg/openmc/commit/b38af0 -.. _d28750: https://github.com/mit-crpg/openmc/commit/d28750 -.. _cf567c: https://github.com/mit-crpg/openmc/commit/cf567c -.. _6b9461: https://github.com/mit-crpg/openmc/commit/6b9461 - ------------- -Contributors ------------- - -This release contains new contributions from the following people: - -- `Sterling Harper `_ -- `Bryan Herman `_ -- `Nick Horelik `_ -- `Adam Nelson `_ -- `Paul Romano `_ -- `Tuomas Viitanen `_ -- `Jon Walsh `_ diff --git a/docs/source/releasenotes/notes_0.6.0.rst b/docs/source/releasenotes/notes_0.6.0.rst deleted file mode 100644 index 3f98c461d..000000000 --- a/docs/source/releasenotes/notes_0.6.0.rst +++ /dev/null @@ -1,59 +0,0 @@ -.. _notes_0.6.0: - -============================== -Release Notes for OpenMC 0.6.0 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, -and Microsoft Windows 7. Memory requirements will vary depending on the size of -the problem at hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- Legendre and spherical harmonic expansion tally scores -- CMake is now default build system -- Regression test suite based on CTests and NNDC cross sections -- FoX is now a git submodule -- Support for older cross sections (e.g. MCNP 66c) -- Progress bar for plots -- Expanded support for natural elements via in settings.xml - ---------- -Bug Fixes ---------- - -- 41f7ca_: Fixed erroneous results from survival biasing -- 038736_: Fix tallies over void materials -- 46f9e8_: Check for negative values in probability tables -- d1ca35_: Fixed sampling of angular distribution -- 0291c0_: Fixed indexing error in plotting -- d7a7d0_: Fix bug with specifying xs attribute -- 85b3cb_: Fix out-of-bounds error with OpenMP threading - -.. _41f7ca: https://github.com/mit-crpg/openmc/commit/41f7ca -.. _038736: https://github.com/mit-crpg/openmc/commit/038736 -.. _46f9e8: https://github.com/mit-crpg/openmc/commit/46f9e8 -.. _d1ca35: https://github.com/mit-crpg/openmc/commit/d1ca35 -.. _0291c0: https://github.com/mit-crpg/openmc/commit/0291c0 -.. _d7a7d0: https://github.com/mit-crpg/openmc/commit/d7a7d0 -.. _85b3cb: https://github.com/mit-crpg/openmc/commit/85b3cb - ------------- -Contributors ------------- - -This release contains new contributions from the following people: - -- `Sterling Harper `_ -- `Bryan Herman `_ -- `Nick Horelik `_ -- `Adam Nelson `_ -- `Paul Romano `_ -- `Jon Walsh `_ diff --git a/docs/source/releasenotes/notes_0.6.1.rst b/docs/source/releasenotes/notes_0.6.1.rst deleted file mode 100644 index 71852bd17..000000000 --- a/docs/source/releasenotes/notes_0.6.1.rst +++ /dev/null @@ -1,65 +0,0 @@ -.. _notes_0.6.1: - -============================== -Release Notes for OpenMC 0.6.1 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, -and Microsoft Windows 7. Memory requirements will vary depending on the size of -the problem at hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- Coarse mesh finite difference (CMFD) acceleration no longer requires PETSc -- Statepoint file numbering is now zero-padded -- Python scripts now compatible with Python 2 or 3 -- Ability to run particle restarts in fixed source calculations -- Capability to filter box source by fissionable materials -- Nuclide/element names are now case insensitive in input files -- Improved treatment of resonance scattering for heavy nuclides - ---------- -Bug Fixes ---------- - -- 03e890_: Check for energy-dependent multiplicities in ACE files -- 4439de_: Fix distance-to-surface calculation for general plane surface -- 5808ed_: Account for differences in URR band probabilities at different energies -- 2e60c0_: Allow zero atom/weight percents in materials -- 3e0870_: Don't use PWD environment variable when setting path to input files -- dc4776_: Handle probability table resampling correctly -- 01178b_: Fix metastables nuclides in NNDC cross_sections.xml file -- 62ec43_: Don't read tallies.xml when OpenMC is run in plotting mode -- 2a95ef_: Prevent segmentation fault on "current" score without mesh filter -- 93e482_: Check for negative values in probability tables - -.. _03e890: https://github.com/mit-crpg/openmc/commit/03e890 -.. _4439de: https://github.com/mit-crpg/openmc/commit/4439de -.. _5808ed: https://github.com/mit-crpg/openmc/commit/5808ed -.. _2e60c0: https://github.com/mit-crpg/openmc/commit/2e60c0 -.. _3e0870: https://github.com/mit-crpg/openmc/commit/3e0870 -.. _dc4776: https://github.com/mit-crpg/openmc/commit/dc4776 -.. _01178b: https://github.com/mit-crpg/openmc/commit/01178b -.. _62ec43: https://github.com/mit-crpg/openmc/commit/62ec43 -.. _2a95ef: https://github.com/mit-crpg/openmc/commit/2a95ef -.. _93e482: https://github.com/mit-crpg/openmc/commit/93e482 - ------------- -Contributors ------------- - -This release contains new contributions from the following people: - -- `Sterling Harper `_ -- `Bryan Herman `_ -- `Adam Nelson `_ -- `Paul Romano `_ -- `Jon Walsh `_ -- `Will Boyd `_ diff --git a/docs/source/releasenotes/notes_0.6.2.rst b/docs/source/releasenotes/notes_0.6.2.rst deleted file mode 100644 index eefc493fc..000000000 --- a/docs/source/releasenotes/notes_0.6.2.rst +++ /dev/null @@ -1,58 +0,0 @@ -.. _notes_0.6.2: - -============================== -Release Notes for OpenMC 0.6.2 -============================== - -------------------- -System Requirements -------------------- - -There are no special requirements for running the OpenMC code. As of this -release, OpenMC has been tested on a variety of Linux distributions, Mac OS X, -and Microsoft Windows 7. Memory requirements will vary depending on the size of -the problem at hand (mostly on the number of nuclides in the problem). - ------------- -New Features ------------- - -- Meshline plotting capability -- Support for plotting cells/materials on middle universe levels -- Ability to model cells with no surfaces -- Compatibility with PETSc 3.5 -- Compatability with OpenMPI 1.7/1.8 -- Improved overall performance via logarithmic-mapped energy grid search -- Improved multi-threaded performance with atomic operations -- Support for fixed source problems with fissionable materials - ---------- -Bug Fixes ---------- - -- 26fb93_: Fix problem with -t, --track command-line flag -- 2f07c0_: Improved evaporation spectrum algorithm -- e6abb9_: Fix segfault when tallying in a void material -- 291b45_: Handle metastable nuclides in NNDC data and multiplicities in MT=5 data - -.. _26fb93: https://github.com/mit-crpg/openmc/commit/26fb93 -.. _2f07c0: https://github.com/mit-crpg/openmc/commit/2f07c0 -.. _e6abb9: https://github.com/mit-crpg/openmc/commit/e6abb9 -.. _291b45: https://github.com/mit-crpg/openmc/commit/291b45 - ------------- -Contributors ------------- - -This release contains new contributions from the following people: - -- `Will Boyd `_ -- `Matt Ellis `_ -- `Sterling Harper `_ -- `Bryan Herman `_ -- `Nicholas Horelik `_ -- `Anton Leontiev `_ -- `Adam Nelson `_ -- `Paul Romano `_ -- `Jon Walsh `_ -- `John Xia `_ From 487562c7a622f09b68249ab13581f367afc77aab Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Tue, 4 Aug 2015 11:01:10 +1000 Subject: [PATCH 16/43] Increment version number to 0.7.0 --- docs/source/conf.py | 4 ++-- setup.py | 2 +- src/constants.F90 | 4 ++-- 3 files changed, 5 insertions(+), 5 deletions(-) diff --git a/docs/source/conf.py b/docs/source/conf.py index 65ee4db6f..4a18f14de 100644 --- a/docs/source/conf.py +++ b/docs/source/conf.py @@ -52,9 +52,9 @@ copyright = u'2011-2015, Massachusetts Institute of Technology' # built documents. # # The short X.Y version. -version = "0.6" +version = "0.7" # The full version, including alpha/beta/rc tags. -release = "0.6.2" +release = "0.7.0" # The language for content autogenerated by Sphinx. Refer to documentation # for a list of supported languages. diff --git a/setup.py b/setup.py index b86582dd0..655e38e3a 100644 --- a/setup.py +++ b/setup.py @@ -10,7 +10,7 @@ except ImportError: have_setuptools = False kwargs = {'name': 'openmc', - 'version': '0.6.2', + 'version': '0.7.0', 'packages': ['openmc'], 'scripts': glob.glob('scripts/openmc-*'), diff --git a/src/constants.F90 b/src/constants.F90 index b1af171ef..3aaf08f0e 100644 --- a/src/constants.F90 +++ b/src/constants.F90 @@ -7,8 +7,8 @@ module constants ! OpenMC major, minor, and release numbers integer, parameter :: VERSION_MAJOR = 0 - integer, parameter :: VERSION_MINOR = 6 - integer, parameter :: VERSION_RELEASE = 2 + integer, parameter :: VERSION_MINOR = 7 + integer, parameter :: VERSION_RELEASE = 0 ! Revision numbers for binary files integer, parameter :: REVISION_STATEPOINT = 13 From 5be8f5b97e8b473ebb61fef90211786a0a416dfa Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Wed, 12 Aug 2015 10:09:22 +0700 Subject: [PATCH 17/43] Fix CTest coverage runs for test_filter_distribcell --- CMakeLists.txt | 16 ++++++++++++++++ 1 file changed, 16 insertions(+) diff --git a/CMakeLists.txt b/CMakeLists.txt index 3bbc353f6..45b626324 100644 --- a/CMakeLists.txt +++ b/CMakeLists.txt @@ -287,6 +287,22 @@ foreach(test ${TESTS}) WORKING_DIRECTORY ${TEST_PATH} COMMAND $ -p ${TEST_PATH}) + elseif(${test} MATCHES "test_filter_distribcell") + + # Add each case for distribcell tests + add_test(NAME ${TEST_NAME}_case-1 + WORKING_DIRECTORY ${TEST_PATH}/case-1 + COMMAND $ ${TEST_PATH}/case-1) + add_test(NAME ${TEST_NAME}_case-2 + WORKING_DIRECTORY ${TEST_PATH}/case-2 + COMMAND $ ${TEST_PATH}/case-2) + add_test(NAME ${TEST_NAME}_case-3 + WORKING_DIRECTORY ${TEST_PATH}/case-3 + COMMAND $ ${TEST_PATH}/case-3) + add_test(NAME ${TEST_NAME}_case-4 + WORKING_DIRECTORY ${TEST_PATH}/case-4 + COMMAND $ ${TEST_PATH}/case-4) + # If a restart test is encounted, need to run with -r and restart file(s) elseif(${test} MATCHES "restart") From 2eeb002a6dcfed292d771fc3d8263e246cdbeda5 Mon Sep 17 00:00:00 2001 From: walshjon Date: Thu, 13 Aug 2015 12:33:13 -0700 Subject: [PATCH 18/43] compute leakage for fixed source runs --- src/eigenvalue.F90 | 14 +++++++------- src/fixed_source.F90 | 15 ++++++++++++++- 2 files changed, 21 insertions(+), 8 deletions(-) diff --git a/src/eigenvalue.F90 b/src/eigenvalue.F90 index 1bbcbe850..c4b9b9a67 100644 --- a/src/eigenvalue.F90 +++ b/src/eigenvalue.F90 @@ -176,19 +176,19 @@ contains !$omp critical global_tallies(K_TRACKLENGTH) % value = & global_tallies(K_TRACKLENGTH) % value + global_tally_tracklength - global_tallies(K_COLLISION) % value = & + global_tallies(K_COLLISION) % value = & global_tallies(K_COLLISION) % value + global_tally_collision - global_tallies(LEAKAGE) % value = & + global_tallies(LEAKAGE) % value = & global_tallies(LEAKAGE) % value + global_tally_leakage - global_tallies(K_ABSORPTION) % value = & + global_tallies(K_ABSORPTION) % value = & global_tallies(K_ABSORPTION) % value + global_tally_absorption !$omp end critical ! reset private tallies - global_tally_tracklength = 0 - global_tally_collision = 0 - global_tally_leakage = 0 - global_tally_absorption = 0 + global_tally_tracklength = ZERO + global_tally_collision = ZERO + global_tally_leakage = ZERO + global_tally_absorption = ZERO !$omp end parallel #ifdef _OPENMP diff --git a/src/fixed_source.F90 b/src/fixed_source.F90 index 9e2d34600..9e7059aa8 100644 --- a/src/fixed_source.F90 +++ b/src/fixed_source.F90 @@ -6,7 +6,7 @@ module fixed_source use constants, only: ZERO, MAX_LINE_LEN use global - use output, only: write_message, header + use output, only: write_message, header, print_batch_leakage use particle_header, only: Particle use random_lcg, only: set_particle_seed use source, only: sample_external_source, copy_source_attributes @@ -117,11 +117,24 @@ contains subroutine finalize_batch() +! Update global tallies with the omp private accumulation variables +!$omp parallel +!$omp critical + global_tallies(LEAKAGE) % value = & + global_tallies(LEAKAGE) % value + global_tally_leakage +!$omp end critical + + ! reset private tallies + global_tally_leakage = ZERO +!$omp end parallel + ! Collect and accumulate tallies call time_tallies % start() call synchronize_tallies() call time_tallies % stop() + if (master) call print_batch_leakage() + ! Check_triggers if (master) call check_triggers() #ifdef MPI From 5cbaffbcc2047843bd053089aac5d102a92744a8 Mon Sep 17 00:00:00 2001 From: walshjon Date: Thu, 13 Aug 2015 12:39:28 -0700 Subject: [PATCH 19/43] remove calls to no-existent subroutine --- src/fixed_source.F90 | 4 +--- 1 file changed, 1 insertion(+), 3 deletions(-) diff --git a/src/fixed_source.F90 b/src/fixed_source.F90 index 9e7059aa8..9dbd57324 100644 --- a/src/fixed_source.F90 +++ b/src/fixed_source.F90 @@ -6,7 +6,7 @@ module fixed_source use constants, only: ZERO, MAX_LINE_LEN use global - use output, only: write_message, header, print_batch_leakage + use output, only: write_message, header use particle_header, only: Particle use random_lcg, only: set_particle_seed use source, only: sample_external_source, copy_source_attributes @@ -133,8 +133,6 @@ contains call synchronize_tallies() call time_tallies % stop() - if (master) call print_batch_leakage() - ! Check_triggers if (master) call check_triggers() #ifdef MPI From d45b9d87d563610805c6c9ca4f816318520223e6 Mon Sep 17 00:00:00 2001 From: walshjon Date: Thu, 13 Aug 2015 14:09:38 -0700 Subject: [PATCH 20/43] print out mean running leakage at each batch --- src/fixed_source.F90 | 13 ++++--- src/global.F90 | 4 +++ src/output.F90 | 80 ++++++++++++++++++++++++++++---------------- 3 files changed, 65 insertions(+), 32 deletions(-) diff --git a/src/fixed_source.F90 b/src/fixed_source.F90 index 9dbd57324..76564ee2f 100644 --- a/src/fixed_source.F90 +++ b/src/fixed_source.F90 @@ -6,7 +6,8 @@ module fixed_source use constants, only: ZERO, MAX_LINE_LEN use global - use output, only: write_message, header + use output, only: write_message, header, print_mean_leak,& + print_columns use particle_header, only: Particle use random_lcg, only: set_particle_seed use source, only: sample_external_source, copy_source_attributes @@ -26,6 +27,7 @@ contains type(Particle) :: p if (master) call header("FIXED SOURCE TRANSPORT SIMULATION", level=1) + if (master) call print_columns() ! Allocate particle and dummy source site !$omp parallel @@ -103,9 +105,6 @@ contains subroutine initialize_batch() - call write_message("Simulating batch " // trim(to_str(current_batch)) & - &// "...", 1) - ! Reset total starting particle weight used for normalizing tallies total_weight = ZERO @@ -133,6 +132,12 @@ contains call synchronize_tallies() call time_tallies % stop() + leak = global_tallies(LEAKAGE) % sum / n_realizations + leak_sem = sqrt(ONE / (n_realizations - ONE) & + * (global_tallies(LEAKAGE) % sum_sq / n_realizations& + - leak * leak)) + if (master) call print_mean_leak() + ! Check_triggers if (master) call check_triggers() #ifdef MPI diff --git a/src/global.F90 b/src/global.F90 index a5ff7453e..b2a563d9e 100644 --- a/src/global.F90 +++ b/src/global.F90 @@ -200,6 +200,10 @@ module global real(8) :: k_abs_tra = ZERO ! sum over batches of k_absorption * k_tracklength real(8) :: k_combined(2) ! combined best estimate of k-effective + ! Temorary leakage values + real(8) :: leak ! running mean leakage + real(8) :: leak_sem ! 1sigma SEM of the running mean leakage + ! Shannon entropy logical :: entropy_on = .false. real(8), allocatable :: entropy(:) ! shannon entropy at each generation diff --git a/src/output.F90 b/src/output.F90 index cd08e4611..ea918b436 100644 --- a/src/output.F90 +++ b/src/output.F90 @@ -7,7 +7,7 @@ module output use endf, only: reaction_name use error, only: fatal_error, warning use geometry_header, only: Cell, Universe, Surface, Lattice, RectLattice, & - &HexLattice, BASE_UNIVERSE + HexLattice, BASE_UNIVERSE use global use math, only: t_percentile use mesh_header, only: StructuredMesh @@ -1346,35 +1346,44 @@ contains subroutine print_columns() - write(UNIT=ou, FMT='(2X,A9,3X)', ADVANCE='NO') "Bat./Gen." - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') " k " - if (entropy_on) write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "Entropy " - write(UNIT=ou, FMT='(A20,3X)', ADVANCE='NO') " Average k " - if (cmfd_run) then - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') " CMFD k " - select case(trim(cmfd_display)) - case('entropy') - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "CMFD Ent" - case('balance') - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "RMS Bal " - case('source') - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "RMS Src " - case('dominance') - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "Dom Rat " - end select - end if - write(UNIT=ou, FMT=*) + select case(run_mode) + case(MODE_EIGENVALUE) + write(UNIT=ou, FMT='(2X,A9,3X)', ADVANCE='NO') "Bat./Gen." + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') " k " + if (entropy_on) write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "Entropy " + write(UNIT=ou, FMT='(A20,3X)', ADVANCE='NO') " Average k " + if (cmfd_run) then + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') " CMFD k " + select case(trim(cmfd_display)) + case('entropy') + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "CMFD Ent" + case('balance') + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "RMS Bal " + case('source') + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "RMS Src " + case('dominance') + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "Dom Rat " + end select + end if + write(UNIT=ou, FMT=*) - write(UNIT=ou, FMT='(2X,A9,3X)', ADVANCE='NO') "=========" - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" - if (entropy_on) write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" - write(UNIT=ou, FMT='(A20,3X)', ADVANCE='NO') "====================" - if (cmfd_run) then + write(UNIT=ou, FMT='(2X,A9,3X)', ADVANCE='NO') "=========" write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" - if (cmfd_display /= '') & - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" - end if - write(UNIT=ou, FMT=*) + if (entropy_on) write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" + write(UNIT=ou, FMT='(A20,3X)', ADVANCE='NO') "====================" + if (cmfd_run) then + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" + if (cmfd_display /= '') & + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" + end if + write(UNIT=ou, FMT=*) + case(MODE_FIXEDSOURCE) + write(ou, '(A10)', advance='no') 'Batch' + write(ou, '(A24)', advance='no') 'Mean Leakage' + write(ou, '(A24)') '1sigma SEM' + case default + continue + end select end subroutine print_columns @@ -1454,6 +1463,21 @@ contains end subroutine print_batch_keff +!=============================================================================== +! PRINT_MEAN_LEAK displays the overall mean system leakage and 1sigma SEM at +! each batch +!=============================================================================== + + subroutine print_mean_leak() + + ! write out information batch and option independent output + write(ou, '(A10)', advance='no') trim(to_str(current_batch)) + write(ou, '(ES24.16)', advance='no') leak + if (n_realizations > 1) write(ou, '(ES24.16)', advance='no') leak_sem + write(ou, *) + + end subroutine print_mean_leak + !=============================================================================== ! PRINT_PLOT displays selected options for plotting !=============================================================================== From 6ecc9ae6a124b61d37bd65ba994683508cc3e514 Mon Sep 17 00:00:00 2001 From: Sterling Harper Date: Thu, 13 Aug 2015 20:51:27 -0600 Subject: [PATCH 21/43] Fix clean_xml.py indentation --- openmc/clean_xml.py | 8 ++++---- 1 file changed, 4 insertions(+), 4 deletions(-) diff --git a/openmc/clean_xml.py b/openmc/clean_xml.py index 619475fa0..2bb3f39f1 100644 --- a/openmc/clean_xml.py +++ b/openmc/clean_xml.py @@ -82,11 +82,11 @@ def clean_xml_indentation(element, level=0): if not element.tail or not element.tail.strip(): element.tail = i - for element in element: - clean_xml_indentation(element, level+1) + for sub_element in element: + clean_xml_indentation(sub_element, level+1) - if not element.tail or not element.tail.strip(): - element.tail = i + if not sub_element.tail or not sub_element.tail.strip(): + sub_element.tail = i else: if level and (not element.tail or not element.tail.strip()): From fc5fd61b7fe533148cea21df0a9997b2ddf5b68d Mon Sep 17 00:00:00 2001 From: walshjon Date: Thu, 13 Aug 2015 23:01:02 -0700 Subject: [PATCH 22/43] incorporate leakage into fixed source test --- tests/test_fixed_source/results_true.dat | 3 +++ tests/test_fixed_source/test_fixed_source.py | 4 ++++ 2 files changed, 7 insertions(+) diff --git a/tests/test_fixed_source/results_true.dat b/tests/test_fixed_source/results_true.dat index 2ec2d00b8..99eb15e10 100644 --- a/tests/test_fixed_source/results_true.dat +++ b/tests/test_fixed_source/results_true.dat @@ -1,3 +1,6 @@ tally 1: 4.483337E+02 2.017057E+04 +leakage: +9.820000E+00 +9.648000E+00 diff --git a/tests/test_fixed_source/test_fixed_source.py b/tests/test_fixed_source/test_fixed_source.py index 1f4382c08..e96a3ad8f 100644 --- a/tests/test_fixed_source/test_fixed_source.py +++ b/tests/test_fixed_source/test_fixed_source.py @@ -28,6 +28,10 @@ class FixedSourceTestHarness(TestHarness): outstr += '\n'.join(results) + '\n' tally_num += 1 + outstr += 'leakage:\n' + outstr += '{0:12.6E}'.format(sp._global_tallies[3][0]) + '\n' + outstr += '{0:12.6E}'.format(sp._global_tallies[3][1]) + '\n' + return outstr From e1868225ddb40ff3cf01bcce8b52232d81c87854 Mon Sep 17 00:00:00 2001 From: walshjon Date: Thu, 13 Aug 2015 23:07:45 -0700 Subject: [PATCH 23/43] simplified hotfix version of PR 440 --- src/fixed_source.F90 | 10 +----- src/global.F90 | 4 --- src/output.F90 | 78 +++++++++++++++----------------------------- 3 files changed, 28 insertions(+), 64 deletions(-) diff --git a/src/fixed_source.F90 b/src/fixed_source.F90 index 76564ee2f..1c34c8f2a 100644 --- a/src/fixed_source.F90 +++ b/src/fixed_source.F90 @@ -6,8 +6,7 @@ module fixed_source use constants, only: ZERO, MAX_LINE_LEN use global - use output, only: write_message, header, print_mean_leak,& - print_columns + use output, only: write_message, header use particle_header, only: Particle use random_lcg, only: set_particle_seed use source, only: sample_external_source, copy_source_attributes @@ -27,7 +26,6 @@ contains type(Particle) :: p if (master) call header("FIXED SOURCE TRANSPORT SIMULATION", level=1) - if (master) call print_columns() ! Allocate particle and dummy source site !$omp parallel @@ -132,12 +130,6 @@ contains call synchronize_tallies() call time_tallies % stop() - leak = global_tallies(LEAKAGE) % sum / n_realizations - leak_sem = sqrt(ONE / (n_realizations - ONE) & - * (global_tallies(LEAKAGE) % sum_sq / n_realizations& - - leak * leak)) - if (master) call print_mean_leak() - ! Check_triggers if (master) call check_triggers() #ifdef MPI diff --git a/src/global.F90 b/src/global.F90 index b2a563d9e..a5ff7453e 100644 --- a/src/global.F90 +++ b/src/global.F90 @@ -200,10 +200,6 @@ module global real(8) :: k_abs_tra = ZERO ! sum over batches of k_absorption * k_tracklength real(8) :: k_combined(2) ! combined best estimate of k-effective - ! Temorary leakage values - real(8) :: leak ! running mean leakage - real(8) :: leak_sem ! 1sigma SEM of the running mean leakage - ! Shannon entropy logical :: entropy_on = .false. real(8), allocatable :: entropy(:) ! shannon entropy at each generation diff --git a/src/output.F90 b/src/output.F90 index ea918b436..939451c6f 100644 --- a/src/output.F90 +++ b/src/output.F90 @@ -1346,44 +1346,35 @@ contains subroutine print_columns() - select case(run_mode) - case(MODE_EIGENVALUE) - write(UNIT=ou, FMT='(2X,A9,3X)', ADVANCE='NO') "Bat./Gen." - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') " k " - if (entropy_on) write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "Entropy " - write(UNIT=ou, FMT='(A20,3X)', ADVANCE='NO') " Average k " - if (cmfd_run) then - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') " CMFD k " - select case(trim(cmfd_display)) - case('entropy') - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "CMFD Ent" - case('balance') - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "RMS Bal " - case('source') - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "RMS Src " - case('dominance') - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "Dom Rat " - end select - end if - write(UNIT=ou, FMT=*) + write(UNIT=ou, FMT='(2X,A9,3X)', ADVANCE='NO') "Bat./Gen." + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') " k " + if (entropy_on) write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "Entropy " + write(UNIT=ou, FMT='(A20,3X)', ADVANCE='NO') " Average k " + if (cmfd_run) then + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') " CMFD k " + select case(trim(cmfd_display)) + case('entropy') + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "CMFD Ent" + case('balance') + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "RMS Bal " + case('source') + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "RMS Src " + case('dominance') + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "Dom Rat " + end select + end if + write(UNIT=ou, FMT=*) - write(UNIT=ou, FMT='(2X,A9,3X)', ADVANCE='NO') "=========" + write(UNIT=ou, FMT='(2X,A9,3X)', ADVANCE='NO') "=========" + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" + if (entropy_on) write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" + write(UNIT=ou, FMT='(A20,3X)', ADVANCE='NO') "====================" + if (cmfd_run) then write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" - if (entropy_on) write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" - write(UNIT=ou, FMT='(A20,3X)', ADVANCE='NO') "====================" - if (cmfd_run) then - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" - if (cmfd_display /= '') & - write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" - end if - write(UNIT=ou, FMT=*) - case(MODE_FIXEDSOURCE) - write(ou, '(A10)', advance='no') 'Batch' - write(ou, '(A24)', advance='no') 'Mean Leakage' - write(ou, '(A24)') '1sigma SEM' - case default - continue - end select + if (cmfd_display /= '') & + write(UNIT=ou, FMT='(A8,3X)', ADVANCE='NO') "========" + end if + write(UNIT=ou, FMT=*) end subroutine print_columns @@ -1463,21 +1454,6 @@ contains end subroutine print_batch_keff -!=============================================================================== -! PRINT_MEAN_LEAK displays the overall mean system leakage and 1sigma SEM at -! each batch -!=============================================================================== - - subroutine print_mean_leak() - - ! write out information batch and option independent output - write(ou, '(A10)', advance='no') trim(to_str(current_batch)) - write(ou, '(ES24.16)', advance='no') leak - if (n_realizations > 1) write(ou, '(ES24.16)', advance='no') leak_sem - write(ou, *) - - end subroutine print_mean_leak - !=============================================================================== ! PRINT_PLOT displays selected options for plotting !=============================================================================== From 2c23d0ac212c2d62bf8aa5c8ebfc96591f8f9f91 Mon Sep 17 00:00:00 2001 From: walshjon Date: Thu, 13 Aug 2015 23:12:07 -0700 Subject: [PATCH 24/43] reinclude the batch count printout --- src/fixed_source.F90 | 3 +++ 1 file changed, 3 insertions(+) diff --git a/src/fixed_source.F90 b/src/fixed_source.F90 index 1c34c8f2a..9dbd57324 100644 --- a/src/fixed_source.F90 +++ b/src/fixed_source.F90 @@ -103,6 +103,9 @@ contains subroutine initialize_batch() + call write_message("Simulating batch " // trim(to_str(current_batch)) & + &// "...", 1) + ! Reset total starting particle weight used for normalizing tallies total_weight = ZERO From 4ca33a4a04ee4e70b9fba463e067857027b7d3a8 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Sat, 15 Aug 2015 09:45:14 +0700 Subject: [PATCH 25/43] Make tallies of the form (scalar op usertally) derived --- openmc/tallies.py | 7 ++++++- 1 file changed, 6 insertions(+), 1 deletion(-) diff --git a/openmc/tallies.py b/openmc/tallies.py index 783768149..6e418a2be 100644 --- a/openmc/tallies.py +++ b/openmc/tallies.py @@ -1457,7 +1457,7 @@ class Tally(object): Raises ------ ValueError - When this method is called before the other tally is populated + When this method is called before the other tally is populated with data by the StatePoint.read_results() method. """ @@ -1674,6 +1674,7 @@ class Tally(object): elif isinstance(other, Real): new_tally = Tally(name='derived') + new_tally._derived = True new_tally.with_batch_statistics = True new_tally.name = self.name new_tally._mean = self._mean + other @@ -1743,6 +1744,7 @@ class Tally(object): elif isinstance(other, Real): new_tally = Tally(name='derived') + new_tally._derived = True new_tally.name = self.name new_tally._mean = self._mean - other new_tally._std_dev = self._std_dev @@ -1812,6 +1814,7 @@ class Tally(object): elif isinstance(other, Real): new_tally = Tally(name='derived') + new_tally._derived = True new_tally.name = self.name new_tally._mean = self._mean * other new_tally._std_dev = self._std_dev * np.abs(other) @@ -1881,6 +1884,7 @@ class Tally(object): elif isinstance(other, Real): new_tally = Tally(name='derived') + new_tally._derived = True new_tally.name = self.name new_tally._mean = self._mean / other new_tally._std_dev = self._std_dev * np.abs(1. / other) @@ -1950,6 +1954,7 @@ class Tally(object): elif isinstance(power, Real): new_tally = Tally(name='derived') + new_tally._derived = True new_tally.name = self.name new_tally._mean = self._mean ** power self_rel_err = self.std_dev / self.mean From cfa629e40630a50143d2bcc0480cddd334ddeecb Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Sat, 15 Aug 2015 11:00:27 +0700 Subject: [PATCH 26/43] Fix source in tally arithmetic notebook --- .../pythonapi/examples/tally-arithmetic.ipynb | 267 +++++++++--------- 1 file changed, 133 insertions(+), 134 deletions(-) diff --git a/docs/source/pythonapi/examples/tally-arithmetic.ipynb b/docs/source/pythonapi/examples/tally-arithmetic.ipynb index a2930a80b..2b1205204 100644 --- a/docs/source/pythonapi/examples/tally-arithmetic.ipynb +++ b/docs/source/pythonapi/examples/tally-arithmetic.ipynb @@ -293,7 +293,7 @@ "settings_file.inactive = inactive\n", "settings_file.particles = particles\n", "settings_file.output = {'tallies': True, 'summary': True}\n", - "source_bounds = [-0.63, -0.63, -10, 0.63, 0.63, 10.]\n", + "source_bounds = [-0.63, -0.63, -0.63, 0.63, 0.63, 0.63]\n", "settings_file.set_source_space('box', source_bounds)\n", "\n", "# Export to \"settings.xml\"\n", @@ -568,9 +568,8 @@ "\n", " Copyright: 2011-2015 Massachusetts Institute of Technology\n", " License: http://mit-crpg.github.io/openmc/license.html\n", - " Version: 0.6.2\n", - " Date/Time: 2015-08-12 08:58:22\n", - " MPI Processes: 4\n", + " Version: 0.7.0\n", + " Date/Time: 2015-08-15 10:52:49\n", "\n", " ===========================================================================\n", " ========================> INITIALIZATION <=========================\n", @@ -596,26 +595,26 @@ "\n", " Bat./Gen. k Average k \n", " ========= ======== ==================== \n", - " 1/1 1.04944 \n", - " 2/1 1.03451 \n", - " 3/1 1.06490 \n", - " 4/1 1.04020 \n", - " 5/1 1.03270 \n", - " 6/1 1.09507 \n", - " 7/1 1.06827 1.08167 +/- 0.01340\n", - " 8/1 1.06089 1.07474 +/- 0.01038\n", - " 9/1 1.03806 1.06557 +/- 0.01175\n", - " 10/1 1.05032 1.06252 +/- 0.00960\n", - " 11/1 1.03259 1.05753 +/- 0.00929\n", - " 12/1 1.02588 1.05301 +/- 0.00906\n", - " 13/1 1.03872 1.05123 +/- 0.00805\n", - " 14/1 1.05396 1.05153 +/- 0.00710\n", - " 15/1 1.03818 1.05019 +/- 0.00649\n", - " 16/1 1.05015 1.05019 +/- 0.00587\n", - " 17/1 1.01418 1.04719 +/- 0.00614\n", - " 18/1 1.07342 1.04921 +/- 0.00600\n", - " 19/1 1.03023 1.04785 +/- 0.00572\n", - " 20/1 1.05405 1.04827 +/- 0.00534\n", + " 1/1 1.00465 \n", + " 2/1 1.05814 \n", + " 3/1 1.05114 \n", + " 4/1 1.09189 \n", + " 5/1 1.03731 \n", + " 6/1 1.03510 \n", + " 7/1 1.09378 1.06444 +/- 0.02934\n", + " 8/1 1.04522 1.05803 +/- 0.01811\n", + " 9/1 1.06557 1.05992 +/- 0.01294\n", + " 10/1 1.05757 1.05945 +/- 0.01004\n", + " 11/1 1.04858 1.05764 +/- 0.00839\n", + " 12/1 1.01832 1.05202 +/- 0.00905\n", + " 13/1 1.05822 1.05279 +/- 0.00787\n", + " 14/1 1.07684 1.05547 +/- 0.00744\n", + " 15/1 1.00349 1.05027 +/- 0.00844\n", + " 16/1 1.06969 1.05203 +/- 0.00784\n", + " 17/1 1.06377 1.05301 +/- 0.00722\n", + " 18/1 1.02897 1.05116 +/- 0.00690\n", + " 19/1 1.00685 1.04800 +/- 0.00713\n", + " 20/1 1.02644 1.04656 +/- 0.00679\n", " Creating state point statepoint.20.h5...\n", "\n", " ===========================================================================\n", @@ -625,27 +624,27 @@ "\n", " =======================> TIMING STATISTICS <=======================\n", "\n", - " Total time for initialization = 9.7500E-01 seconds\n", - " Reading cross sections = 2.8800E-01 seconds\n", - " Total time in simulation = 8.2720E+00 seconds\n", - " Time in transport only = 7.8820E+00 seconds\n", - " Time in inactive batches = 1.0260E+00 seconds\n", - " Time in active batches = 7.2460E+00 seconds\n", - " Time synchronizing fission bank = 1.9500E-01 seconds\n", + " Total time for initialization = 4.4100E-01 seconds\n", + " Reading cross sections = 1.1300E-01 seconds\n", + " Total time in simulation = 1.8418E+01 seconds\n", + " Time in transport only = 1.8403E+01 seconds\n", + " Time in inactive batches = 2.1070E+00 seconds\n", + " Time in active batches = 1.6311E+01 seconds\n", + " Time synchronizing fission bank = 2.0000E-03 seconds\n", " Sampling source sites = 2.0000E-03 seconds\n", " SEND/RECV source sites = 0.0000E+00 seconds\n", " Time accumulating tallies = 0.0000E+00 seconds\n", - " Total time for finalization = 2.0000E-03 seconds\n", - " Total time elapsed = 9.2580E+00 seconds\n", - " Calculation Rate (inactive) = 12183.2 neutrons/second\n", - " Calculation Rate (active) = 5175.27 neutrons/second\n", + " Total time for finalization = 1.0000E-03 seconds\n", + " Total time elapsed = 1.8861E+01 seconds\n", + " Calculation Rate (inactive) = 5932.61 neutrons/second\n", + " Calculation Rate (active) = 2299.06 neutrons/second\n", "\n", " ============================> RESULTS <============================\n", "\n", - " k-effective (Collision) = 1.04399 +/- 0.00515\n", - " k-effective (Track-length) = 1.04827 +/- 0.00534\n", - " k-effective (Absorption) = 1.03932 +/- 0.00588\n", - " Combined k-effective = 1.04364 +/- 0.00533\n", + " k-effective (Collision) = 1.04599 +/- 0.00622\n", + " k-effective (Track-length) = 1.04656 +/- 0.00679\n", + " k-effective (Absorption) = 1.04614 +/- 0.00461\n", + " Combined k-effective = 1.04651 +/- 0.00368\n", " Leakage Fraction = 0.00000 +/- 0.00000\n", "\n" ] @@ -666,7 +665,7 @@ "!rm statepoint.*\n", "\n", "# Run OpenMC with MPI!\n", - "executor.run_simulation(mpi_procs=4)" + "executor.run_simulation()" ] }, { @@ -760,8 +759,8 @@ " 0\n", " total\n", " (nu-fission / absorption)\n", - " 1.042035\n", - " 0.006584\n", + " 1.042726\n", + " 0.008661\n", " \n", " \n", "\n", @@ -770,7 +769,7 @@ "text/plain": [ " nuclide score mean std. dev.\n", "bin \n", - "0 total (nu-fission / absorption) 1.042035 0.006584" + "0 total (nu-fission / absorption) 1.042726 0.008661" ] }, "execution_count": 26, @@ -828,8 +827,8 @@ " 0\n", " total\n", " absorption\n", - " 0.959067\n", - " 0.00517\n", + " 0.958874\n", + " 0.007146\n", " \n", " \n", "\n", @@ -838,7 +837,7 @@ "text/plain": [ " nuclide score mean std. dev.\n", "bin \n", - "0 total absorption 0.959067 0.00517" + "0 total absorption 0.958874 0.007146" ] }, "execution_count": 27, @@ -894,8 +893,8 @@ " 0\n", " total\n", " nu-fission\n", - " 1.09144\n", - " 0.008201\n", + " 1.09186\n", + " 0.010424\n", " \n", " \n", "\n", @@ -904,7 +903,7 @@ "text/plain": [ " nuclide score mean std. dev.\n", "bin \n", - "0 total nu-fission 1.09144 0.008201" + "0 total nu-fission 1.09186 0.010424" ] }, "execution_count": 28, @@ -967,8 +966,8 @@ " 10000\n", " total\n", " absorption\n", - " 0.802094\n", - " 0.004432\n", + " 0.802921\n", + " 0.006109\n", " \n", " \n", "\n", @@ -977,7 +976,7 @@ "text/plain": [ " energy [MeV] cell nuclide score mean std. dev.\n", "bin \n", - "0 0.0e+00 - 6.2e-01 10000 total absorption 0.802094 0.004432" + "0 0.0e+00 - 6.2e-01 10000 total absorption 0.802921 0.006109" ] }, "execution_count": 29, @@ -1038,8 +1037,8 @@ " 10000\n", " total\n", " (nu-fission / absorption)\n", - " 1.241103\n", - " 0.008414\n", + " 1.240421\n", + " 0.010978\n", " \n", " \n", "\n", @@ -1048,11 +1047,11 @@ "text/plain": [ " energy [MeV] cell nuclide score mean \\\n", "bin \n", - "0 0.0e+00 - 6.2e-01 10000 total (nu-fission / absorption) 1.241103 \n", + "0 0.0e+00 - 6.2e-01 10000 total (nu-fission / absorption) 1.240421 \n", "\n", " std. dev. \n", "bin \n", - "0 0.008414 " + "0 0.010978 " ] }, "execution_count": 30, @@ -1106,8 +1105,8 @@ " 0\n", " total\n", " (((absorption * nu-fission) * absorption) * (n...\n", - " 1.042035\n", - " 0.013263\n", + " 1.042726\n", + " 0.017538\n", " \n", " \n", "\n", @@ -1116,11 +1115,11 @@ "text/plain": [ " nuclide score mean \\\n", "bin \n", - "0 total (((absorption * nu-fission) * absorption) * (n... 1.042035 \n", + "0 total (((absorption * nu-fission) * absorption) * (n... 1.042726 \n", "\n", " std. dev. \n", "bin \n", - "0 0.013263 " + "0 0.017538 " ] }, "execution_count": 31, @@ -1198,7 +1197,7 @@ " (U-238 / total)\n", " (nu-fission / flux)\n", " 0.000001\n", - " 5.999638e-09\n", + " 6.985151e-09\n", " \n", " \n", " 1\n", @@ -1206,8 +1205,8 @@ " 0.0e+00 - 6.3e-07\n", " (U-238 / total)\n", " (scatter / flux)\n", - " 0.209985\n", - " 1.975043e-03\n", + " 0.209988\n", + " 2.206753e-03\n", " \n", " \n", " 2\n", @@ -1215,8 +1214,8 @@ " 0.0e+00 - 6.3e-07\n", " (U-235 / total)\n", " (nu-fission / flux)\n", - " 0.355600\n", - " 3.196431e-03\n", + " 0.355276\n", + " 3.741612e-03\n", " \n", " \n", " 3\n", @@ -1225,7 +1224,7 @@ " (U-235 / total)\n", " (scatter / flux)\n", " 0.005555\n", - " 5.223274e-05\n", + " 5.842517e-05\n", " \n", " \n", " 4\n", @@ -1233,8 +1232,8 @@ " 6.3e-07 - 2.0e+01\n", " (U-238 / total)\n", " (nu-fission / flux)\n", - " 0.007200\n", - " 7.935962e-05\n", + " 0.007229\n", + " 5.951357e-05\n", " \n", " \n", " 5\n", @@ -1242,8 +1241,8 @@ " 6.3e-07 - 2.0e+01\n", " (U-238 / total)\n", " (scatter / flux)\n", - " 0.227534\n", - " 8.747338e-04\n", + " 0.227642\n", + " 9.496469e-04\n", " \n", " \n", " 6\n", @@ -1251,8 +1250,8 @@ " 6.3e-07 - 2.0e+01\n", " (U-235 / total)\n", " (nu-fission / flux)\n", - " 0.008090\n", - " 4.645182e-05\n", + " 0.008076\n", + " 5.699123e-05\n", " \n", " \n", " 7\n", @@ -1260,8 +1259,8 @@ " 6.3e-07 - 2.0e+01\n", " (U-235 / total)\n", " (scatter / flux)\n", - " 0.003370\n", - " 1.274353e-05\n", + " 0.003369\n", + " 1.369755e-05\n", " \n", " \n", "\n", @@ -1271,24 +1270,24 @@ " cell energy [MeV] nuclide score mean \\\n", "bin \n", "0 10000 0.0e+00 - 6.3e-07 (U-238 / total) (nu-fission / flux) 0.000001 \n", - "1 10000 0.0e+00 - 6.3e-07 (U-238 / total) (scatter / flux) 0.209985 \n", - "2 10000 0.0e+00 - 6.3e-07 (U-235 / total) (nu-fission / flux) 0.355600 \n", + "1 10000 0.0e+00 - 6.3e-07 (U-238 / total) (scatter / flux) 0.209988 \n", + "2 10000 0.0e+00 - 6.3e-07 (U-235 / total) (nu-fission / flux) 0.355276 \n", "3 10000 0.0e+00 - 6.3e-07 (U-235 / total) (scatter / flux) 0.005555 \n", - "4 10000 6.3e-07 - 2.0e+01 (U-238 / total) (nu-fission / flux) 0.007200 \n", - "5 10000 6.3e-07 - 2.0e+01 (U-238 / total) (scatter / flux) 0.227534 \n", - "6 10000 6.3e-07 - 2.0e+01 (U-235 / total) (nu-fission / flux) 0.008090 \n", - "7 10000 6.3e-07 - 2.0e+01 (U-235 / total) (scatter / flux) 0.003370 \n", + "4 10000 6.3e-07 - 2.0e+01 (U-238 / total) (nu-fission / flux) 0.007229 \n", + "5 10000 6.3e-07 - 2.0e+01 (U-238 / total) (scatter / flux) 0.227642 \n", + "6 10000 6.3e-07 - 2.0e+01 (U-235 / total) (nu-fission / flux) 0.008076 \n", + "7 10000 6.3e-07 - 2.0e+01 (U-235 / total) (scatter / flux) 0.003369 \n", "\n", " std. dev. \n", "bin \n", - "0 5.999638e-09 \n", - "1 1.975043e-03 \n", - "2 3.196431e-03 \n", - "3 5.223274e-05 \n", - "4 7.935962e-05 \n", - "5 8.747338e-04 \n", - "6 4.645182e-05 \n", - "7 1.274353e-05 " + "0 6.985151e-09 \n", + "1 2.206753e-03 \n", + "2 3.741612e-03 \n", + "3 5.842517e-05 \n", + "4 5.951357e-05 \n", + "5 9.496469e-04 \n", + "6 5.699123e-05 \n", + "7 1.369755e-05 " ] }, "execution_count": 33, @@ -1319,11 +1318,11 @@ "name": "stdout", "output_type": "stream", "text": [ - "[[[ 6.64202005e-07]\n", - " [ 3.55599908e-01]]\n", + "[[[ 6.63809296e-07]\n", + " [ 3.55275544e-01]]\n", "\n", - " [[ 7.20046753e-03]\n", - " [ 8.09041760e-03]]]\n" + " [[ 7.22895528e-03]\n", + " [ 8.07565148e-03]]]\n" ] } ], @@ -1351,9 +1350,9 @@ "name": "stdout", "output_type": "stream", "text": [ - "[[[ 0.00555494]]\n", + "[[[ 0.00555505]]\n", "\n", - " [[ 0.00337012]]]\n" + " [[ 0.0033688 ]]]\n" ] } ], @@ -1375,8 +1374,8 @@ "name": "stdout", "output_type": "stream", "text": [ - "[[[ 0.22753371]\n", - " [ 0.00337012]]]\n" + "[[[ 0.2276418]\n", + " [ 0.0033688]]]\n" ] } ], @@ -1435,7 +1434,7 @@ " U-238\n", " nu-fission\n", " 0.000002\n", - " 9.952309e-09\n", + " 1.211808e-08\n", " \n", " \n", " 1\n", @@ -1443,8 +1442,8 @@ " 0.0e+00 - 6.3e-07\n", " U-235\n", " nu-fission\n", - " 0.871994\n", - " 5.271360e-03\n", + " 0.870360\n", + " 6.496431e-03\n", " \n", " \n", " 2\n", @@ -1452,8 +1451,8 @@ " 6.3e-07 - 2.0e+01\n", " U-238\n", " nu-fission\n", - " 0.083006\n", - " 8.813292e-04\n", + " 0.083226\n", + " 6.367951e-04\n", " \n", " \n", " 3\n", @@ -1461,8 +1460,8 @@ " 6.3e-07 - 2.0e+01\n", " U-235\n", " nu-fission\n", - " 0.093265\n", - " 4.590785e-04\n", + " 0.092974\n", + " 5.921990e-04\n", " \n", " \n", "\n", @@ -1471,10 +1470,10 @@ "text/plain": [ " cell energy [MeV] nuclide score mean std. dev.\n", "bin \n", - "0 10000 0.0e+00 - 6.3e-07 U-238 nu-fission 0.000002 9.952309e-09\n", - "1 10000 0.0e+00 - 6.3e-07 U-235 nu-fission 0.871994 5.271360e-03\n", - "2 10000 6.3e-07 - 2.0e+01 U-238 nu-fission 0.083006 8.813292e-04\n", - "3 10000 6.3e-07 - 2.0e+01 U-235 nu-fission 0.093265 4.590785e-04" + "0 10000 0.0e+00 - 6.3e-07 U-238 nu-fission 0.000002 1.211808e-08\n", + "1 10000 0.0e+00 - 6.3e-07 U-235 nu-fission 0.870360 6.496431e-03\n", + "2 10000 6.3e-07 - 2.0e+01 U-238 nu-fission 0.083226 6.367951e-04\n", + "3 10000 6.3e-07 - 2.0e+01 U-235 nu-fission 0.092974 5.921990e-04" ] }, "execution_count": 37, @@ -1527,8 +1526,8 @@ " 1.0e-08 - 1.1e-07\n", " H-1\n", " scatter\n", - " 4.669535\n", - " 0.032937\n", + " 4.638428\n", + " 0.034134\n", " \n", " \n", " 1\n", @@ -1536,8 +1535,8 @@ " 1.1e-07 - 1.2e-06\n", " H-1\n", " scatter\n", - " 2.034786\n", - " 0.014311\n", + " 2.050818\n", + " 0.010745\n", " \n", " \n", " 2\n", @@ -1545,8 +1544,8 @@ " 1.2e-06 - 1.3e-05\n", " H-1\n", " scatter\n", - " 1.664440\n", - " 0.014963\n", + " 1.656905\n", + " 0.009480\n", " \n", " \n", " 3\n", @@ -1554,8 +1553,8 @@ " 1.3e-05 - 1.4e-04\n", " H-1\n", " scatter\n", - " 1.875406\n", - " 0.011341\n", + " 1.870808\n", + " 0.011883\n", " \n", " \n", " 4\n", @@ -1563,8 +1562,8 @@ " 1.4e-04 - 1.5e-03\n", " H-1\n", " scatter\n", - " 2.065055\n", - " 0.013958\n", + " 2.045621\n", + " 0.011414\n", " \n", " \n", " 5\n", @@ -1572,8 +1571,8 @@ " 1.5e-03 - 1.6e-02\n", " H-1\n", " scatter\n", - " 2.144462\n", - " 0.011313\n", + " 2.163297\n", + " 0.008725\n", " \n", " \n", " 6\n", @@ -1581,8 +1580,8 @@ " 1.6e-02 - 1.7e-01\n", " H-1\n", " scatter\n", - " 2.206529\n", - " 0.011302\n", + " 2.202045\n", + " 0.013500\n", " \n", " \n", " 7\n", @@ -1590,8 +1589,8 @@ " 1.7e-01 - 1.9e+00\n", " H-1\n", " scatter\n", - " 1.992336\n", - " 0.012023\n", + " 1.996977\n", + " 0.010791\n", " \n", " \n", " 8\n", @@ -1599,8 +1598,8 @@ " 1.9e+00 - 2.0e+01\n", " H-1\n", " scatter\n", - " 0.377400\n", - " 0.004341\n", + " 0.370890\n", + " 0.003597\n", " \n", " \n", "\n", @@ -1609,15 +1608,15 @@ "text/plain": [ " cell energy [MeV] nuclide score mean std. dev.\n", "bin \n", - "0 10002 1.0e-08 - 1.1e-07 H-1 scatter 4.669535 0.032937\n", - "1 10002 1.1e-07 - 1.2e-06 H-1 scatter 2.034786 0.014311\n", - "2 10002 1.2e-06 - 1.3e-05 H-1 scatter 1.664440 0.014963\n", - "3 10002 1.3e-05 - 1.4e-04 H-1 scatter 1.875406 0.011341\n", - "4 10002 1.4e-04 - 1.5e-03 H-1 scatter 2.065055 0.013958\n", - "5 10002 1.5e-03 - 1.6e-02 H-1 scatter 2.144462 0.011313\n", - "6 10002 1.6e-02 - 1.7e-01 H-1 scatter 2.206529 0.011302\n", - "7 10002 1.7e-01 - 1.9e+00 H-1 scatter 1.992336 0.012023\n", - "8 10002 1.9e+00 - 2.0e+01 H-1 scatter 0.377400 0.004341" + "0 10002 1.0e-08 - 1.1e-07 H-1 scatter 4.638428 0.034134\n", + "1 10002 1.1e-07 - 1.2e-06 H-1 scatter 2.050818 0.010745\n", + "2 10002 1.2e-06 - 1.3e-05 H-1 scatter 1.656905 0.009480\n", + "3 10002 1.3e-05 - 1.4e-04 H-1 scatter 1.870808 0.011883\n", + "4 10002 1.4e-04 - 1.5e-03 H-1 scatter 2.045621 0.011414\n", + "5 10002 1.5e-03 - 1.6e-02 H-1 scatter 2.163297 0.008725\n", + "6 10002 1.6e-02 - 1.7e-01 H-1 scatter 2.202045 0.013500\n", + "7 10002 1.7e-01 - 1.9e+00 H-1 scatter 1.996977 0.010791\n", + "8 10002 1.9e+00 - 2.0e+01 H-1 scatter 0.370890 0.003597" ] }, "execution_count": 38, From 3d1af11b6c5783155f1e06ff84cdfcc1806fe535 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Wed, 19 Aug 2015 09:36:46 +0700 Subject: [PATCH 27/43] Fix hyperlink in documentation --- docs/source/developers.rst | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/docs/source/developers.rst b/docs/source/developers.rst index 56ce5e14a..d82d89744 100644 --- a/docs/source/developers.rst +++ b/docs/source/developers.rst @@ -11,7 +11,7 @@ Active development of the OpenMC Monte Carlo code is currently led by: * `Nick Horelik `_ * `Adam Nelson `_ * `Jon Walsh `_ -* `Sterling Harper `_ +* `Sterling Harper `_ * `Will Boyd `_ * `Benoit Forget `_ * `Kord Smith `_ From 2c8c771998a37f4746352d3ce0675221d904992d Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Wed, 1 Jul 2015 16:34:19 +0700 Subject: [PATCH 28/43] Change fixed source simulations to use source_bank rather than dummy source site. This makes fixed source and eigenvalue modes more similar. --- CMakeLists.txt | 2 +- src/eigenvalue.F90 | 4 +- src/fixed_source.F90 | 50 +++---------------- src/global.F90 | 4 -- src/initialize.F90 | 45 ++++++++--------- src/particle_restart_write.F90 | 7 +-- src/source.F90 | 2 +- tests/test_fixed_source/results_true.dat | 8 +-- .../results_true.dat | 8 +-- .../test_particle_restart_fixed.py | 2 +- 10 files changed, 44 insertions(+), 88 deletions(-) diff --git a/CMakeLists.txt b/CMakeLists.txt index 45b626324..b6bafd546 100644 --- a/CMakeLists.txt +++ b/CMakeLists.txt @@ -317,7 +317,7 @@ foreach(test ${TESTS}) elseif(${test} MATCHES "test_particle_restart_eigval") set(RESTART_FILE particle_12_616.h5) elseif(${test} MATCHES "test_particle_restart_fixed") - set(RESTART_FILE particle_7_6144.h5) + set(RESTART_FILE particle_7_928.h5) else(${test} MATCHES "test_statepoint_restart") message(FATAL_ERROR "Restart test ${test} not recognized") endif(${test} MATCHES "test_statepoint_restart") diff --git a/src/eigenvalue.F90 b/src/eigenvalue.F90 index c4b9b9a67..6c8825579 100644 --- a/src/eigenvalue.F90 +++ b/src/eigenvalue.F90 @@ -16,7 +16,7 @@ module eigenvalue use particle_header, only: Particle use random_lcg, only: prn, set_particle_seed, prn_skip use search, only: binary_search - use source, only: get_source_particle + use source, only: get_source_particle, initialize_source use state_point, only: write_state_point, write_source_point use string, only: to_str use tally, only: synchronize_tallies, setup_active_usertallies, & @@ -44,6 +44,8 @@ contains type(Particle) :: p integer(8) :: i_work + if (.not. restart_run) call initialize_source() + if (master) call header("K EIGENVALUE SIMULATION", level=1) ! Display column titles diff --git a/src/fixed_source.F90 b/src/fixed_source.F90 index 9dbd57324..c0397fe0b 100644 --- a/src/fixed_source.F90 +++ b/src/fixed_source.F90 @@ -9,7 +9,7 @@ module fixed_source use output, only: write_message, header use particle_header, only: Particle use random_lcg, only: set_particle_seed - use source, only: sample_external_source, copy_source_attributes + use source, only: initialize_source, get_source_particle use state_point, only: write_state_point use string, only: to_str use tally, only: synchronize_tallies, setup_active_usertallies @@ -22,16 +22,13 @@ contains subroutine run_fixedsource() - integer(8) :: i ! index over histories in single cycle type(Particle) :: p + integer(8) :: i_work ! index over histories in single cycle + + if (.not. restart_run) call initialize_source() if (master) call header("FIXED SOURCE TRANSPORT SIMULATION", level=1) - ! Allocate particle and dummy source site -!$omp parallel - allocate(source_site) -!$omp end parallel - ! Turn timer and tallies on tallies_on = .true. !$omp parallel @@ -50,6 +47,7 @@ contains end if call initialize_batch() + overall_gen = current_batch ! Start timer for transport call time_transport % start() @@ -57,21 +55,11 @@ contains ! ======================================================================= ! LOOP OVER PARTICLES !$omp parallel do schedule(static) firstprivate(p) - PARTICLE_LOOP: do i = 1, work - - ! Set unique particle ID - p % id = (current_batch - 1)*n_particles + work_index(rank) + i - - ! set particle trace - trace = .false. - if (current_batch == trace_batch .and. current_gen == trace_gen .and. & - work_index(rank) + i == trace_particle) trace = .true. - - ! set random number seed - call set_particle_seed(p % id) + PARTICLE_LOOP: do i_work = 1, work + current_work = i_work ! grab source particle from bank - call sample_source_particle(p) + call get_source_particle(p, current_work) ! transport particle call transport(p) @@ -151,26 +139,4 @@ contains end subroutine finalize_batch -!=============================================================================== -! SAMPLE_SOURCE_PARTICLE -!=============================================================================== - - subroutine sample_source_particle(p) - - type(Particle), intent(inout) :: p - - ! Set particle - call p % initialize() - - ! Sample the external source distribution - call sample_external_source(source_site) - - ! Copy source attributes to the particle - call copy_source_attributes(p, source_site) - - ! Determine whether to create track file - if (write_all_tracks) p % write_track = .true. - - end subroutine sample_source_particle - end module fixed_source diff --git a/src/global.F90 b/src/global.F90 index a5ff7453e..564fcda84 100644 --- a/src/global.F90 +++ b/src/global.F90 @@ -283,10 +283,6 @@ module global ! Mode to run in (fixed source, eigenvalue, plotting, etc) integer :: run_mode = NONE - ! Fixed source particle bank - type(Bank), pointer :: source_site => null() -!$omp threadprivate(source_site) - ! Restart run logical :: restart_run = .false. integer :: restart_batch diff --git a/src/initialize.F90 b/src/initialize.F90 index 409d531a3..fd63963bf 100644 --- a/src/initialize.F90 +++ b/src/initialize.F90 @@ -20,7 +20,6 @@ module initialize write_message use output_interface use random_lcg, only: initialize_prng - use source, only: initialize_source use state_point, only: load_state_point use string, only: to_str, str_to_int, starts_with, ends_with use tally_header, only: TallyObject, TallyResult, TallyFilter @@ -141,13 +140,9 @@ contains ! Determine how much work each processor should do call calculate_work() - ! Allocate banks and create source particles -- for a fixed source - ! calculation, the external source distribution is sampled during the - ! run, not at initialization - if (run_mode == MODE_EIGENVALUE) then - call allocate_banks() - if (.not. restart_run) call initialize_source() - end if + ! Allocate source bank, and for eigenvalu simulations also allocate the + ! fission bank + call allocate_banks() ! If this is a restart run, load the state point data and binary source ! file @@ -904,31 +899,33 @@ contains call fatal_error("Failed to allocate source bank.") end if + if (run_mode == MODE_EIGENVALUE) then #ifdef _OPENMP - ! If OpenMP is being used, each thread needs its own private fission - ! bank. Since the private fission banks need to be combined at the end of a - ! generation, there is also a 'master_fission_bank' that is used to collect - ! the sites from each thread. + ! If OpenMP is being used, each thread needs its own private fission + ! bank. Since the private fission banks need to be combined at the end of + ! a generation, there is also a 'master_fission_bank' that is used to + ! collect the sites from each thread. - n_threads = omp_get_max_threads() + n_threads = omp_get_max_threads() !$omp parallel - thread_id = omp_get_thread_num() + thread_id = omp_get_thread_num() - if (thread_id == 0) then - allocate(fission_bank(3*work)) - else - allocate(fission_bank(3*work/n_threads)) - end if + if (thread_id == 0) then + allocate(fission_bank(3*work)) + else + allocate(fission_bank(3*work/n_threads)) + end if !$omp end parallel - allocate(master_fission_bank(3*work), STAT=alloc_err) + allocate(master_fission_bank(3*work), STAT=alloc_err) #else - allocate(fission_bank(3*work), STAT=alloc_err) + allocate(fission_bank(3*work), STAT=alloc_err) #endif - ! Check for allocation errors - if (alloc_err /= 0) then - call fatal_error("Failed to allocate fission bank.") + ! Check for allocation errors + if (alloc_err /= 0) then + call fatal_error("Failed to allocate fission bank.") + end if end if end subroutine allocate_banks diff --git a/src/particle_restart_write.F90 b/src/particle_restart_write.F90 index 0ac55bd27..f138a6740 100644 --- a/src/particle_restart_write.F90 +++ b/src/particle_restart_write.F90 @@ -43,12 +43,7 @@ contains call pr % file_create(filename) ! Get information about source particle - select case (run_mode) - case (MODE_EIGENVALUE) - src => source_bank(current_work) - case (MODE_FIXEDSOURCE) - src => source_site - end select + src => source_bank(current_work) ! Write data to file call pr % write_data(FILETYPE_PARTICLE_RESTART, 'filetype') diff --git a/src/source.F90 b/src/source.F90 index 7cfdcf655..04b5ac760 100644 --- a/src/source.F90 +++ b/src/source.F90 @@ -78,7 +78,7 @@ contains ! Write out initial source if (write_initial_source) then - call write_message('Writing out initial source guess...', 1) + call write_message('Writing out initial source...', 1) #ifdef HDF5 filename = trim(path_output) // 'initial_source.h5' #else diff --git a/tests/test_fixed_source/results_true.dat b/tests/test_fixed_source/results_true.dat index 99eb15e10..094030188 100644 --- a/tests/test_fixed_source/results_true.dat +++ b/tests/test_fixed_source/results_true.dat @@ -1,6 +1,6 @@ tally 1: -4.483337E+02 -2.017057E+04 +4.538791E+02 +2.073271E+04 leakage: -9.820000E+00 -9.648000E+00 +9.830000E+00 +9.663900E+00 diff --git a/tests/test_particle_restart_fixed/results_true.dat b/tests/test_particle_restart_fixed/results_true.dat index ffe7d2cae..81aed707c 100644 --- a/tests/test_particle_restart_fixed/results_true.dat +++ b/tests/test_particle_restart_fixed/results_true.dat @@ -3,14 +3,14 @@ current batch: current gen: 0.000000E+00 particle id: -6.144000E+03 +9.280000E+02 run mode: 1.000000E+00 particle weight: 1.000000E+00 particle energy: -5.749729E+00 +4.412022E+00 particle xyz: -8.754675E+00 2.551620E+00 4.394350E-01 +5.572639E+00 -9.139472E+00 -1.974824E+00 particle uvw: --5.971721E-01 -4.845709E-01 6.391999E-01 +1.410422E-01 5.330426E-01 -8.342498E-01 diff --git a/tests/test_particle_restart_fixed/test_particle_restart_fixed.py b/tests/test_particle_restart_fixed/test_particle_restart_fixed.py index 05dcf76a6..385a42940 100644 --- a/tests/test_particle_restart_fixed/test_particle_restart_fixed.py +++ b/tests/test_particle_restart_fixed/test_particle_restart_fixed.py @@ -6,5 +6,5 @@ from testing_harness import ParticleRestartTestHarness if __name__ == '__main__': - harness = ParticleRestartTestHarness('particle_7_6144.*') + harness = ParticleRestartTestHarness('particle_7_928.*') harness.main() From 14c62e70b69a2455571cd0bdb03caedfbe4c3f1c Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Thu, 2 Jul 2015 20:01:24 +0700 Subject: [PATCH 29/43] Combined main batch/particle loop structure for eigenvalue and fixed source simulations in one 'simulation' mode. The fixed_source module is now gone, and the eigenvalue module consists specifically of eigenvalue-related subroutines. --- src/eigenvalue.F90 | 286 +-------------- src/fixed_source.F90 | 142 -------- src/main.F90 | 9 +- src/simulation.F90 | 325 ++++++++++++++++++ .../results_true.dat | 2 +- 5 files changed, 331 insertions(+), 433 deletions(-) delete mode 100644 src/fixed_source.F90 create mode 100644 src/simulation.F90 diff --git a/src/eigenvalue.F90 b/src/eigenvalue.F90 index 6c8825579..6a4591705 100644 --- a/src/eigenvalue.F90 +++ b/src/eigenvalue.F90 @@ -4,275 +4,24 @@ module eigenvalue use message_passing #endif - use cmfd_execute, only: cmfd_init_batch, execute_cmfd use constants, only: ZERO use error, only: fatal_error, warning use global use math, only: t_percentile use mesh, only: count_bank_sites use mesh_header, only: StructuredMesh - use output, only: write_message, header, print_columns, & - print_batch_keff, print_generation use particle_header, only: Particle use random_lcg, only: prn, set_particle_seed, prn_skip use search, only: binary_search - use source, only: get_source_particle, initialize_source - use state_point, only: write_state_point, write_source_point use string, only: to_str - use tally, only: synchronize_tallies, setup_active_usertallies, & - reset_result - use trigger, only: check_triggers - use tracking, only: transport implicit none - private - public :: run_eigenvalue - real(8) :: keff_generation ! Single-generation k on each - ! processor - real(8) :: k_sum(2) = ZERO ! Used to reduce sum and sum_sq + real(8) :: keff_generation ! Single-generation k on each processor + real(8) :: k_sum(2) = ZERO ! Used to reduce sum and sum_sq contains -!=============================================================================== -! RUN_EIGENVALUE encompasses all the main logic where iterations are performed -! over the batches, generations, and histories in a k-eigenvalue calculation. -!=============================================================================== - - subroutine run_eigenvalue() - - type(Particle) :: p - integer(8) :: i_work - - if (.not. restart_run) call initialize_source() - - if (master) call header("K EIGENVALUE SIMULATION", level=1) - - ! Display column titles - if(master) call print_columns() - - ! Turn on inactive timer - call time_inactive % start() - - ! ========================================================================== - ! LOOP OVER BATCHES - BATCH_LOOP: do current_batch = 1, n_max_batches - - call initialize_batch() - - ! Handle restart runs - if (restart_run .and. current_batch <= restart_batch) then - call replay_batch_history() - cycle BATCH_LOOP - end if - - ! ======================================================================= - ! LOOP OVER GENERATIONS - GENERATION_LOOP: do current_gen = 1, gen_per_batch - - call initialize_generation() - - ! Start timer for transport - call time_transport % start() - - ! ==================================================================== - ! LOOP OVER PARTICLES -!$omp parallel do schedule(static) firstprivate(p) - PARTICLE_LOOP: do i_work = 1, work - current_work = i_work - - ! grab source particle from bank - call get_source_particle(p, current_work) - - ! transport particle - call transport(p) - - end do PARTICLE_LOOP -!$omp end parallel do - - ! Accumulate time for transport - call time_transport % stop() - - call finalize_generation() - - end do GENERATION_LOOP - - call finalize_batch() - - if (satisfy_triggers) exit BATCH_LOOP - - end do BATCH_LOOP - - call time_active % stop() - - ! ========================================================================== - ! END OF RUN WRAPUP - - if (master) call header("SIMULATION FINISHED", level=1) - - ! Clear particle - call p % clear() - - end subroutine run_eigenvalue - -!=============================================================================== -! INITIALIZE_BATCH -!=============================================================================== - - subroutine initialize_batch() - - call write_message("Simulating batch " // trim(to_str(current_batch)) & - &// "...", 8) - - ! Reset total starting particle weight used for normalizing tallies - total_weight = ZERO - - if (current_batch == n_inactive + 1) then - ! Switch from inactive batch timer to active batch timer - call time_inactive % stop() - call time_active % start() - - ! Enable active batches (and tallies_on if it hasn't been enabled) - active_batches = .true. - tallies_on = .true. - - ! Add user tallies to active tallies list -!$omp parallel - call setup_active_usertallies() -!$omp end parallel - end if - - ! check CMFD initialize batch - if (cmfd_run) call cmfd_init_batch() - - end subroutine initialize_batch - -!=============================================================================== -! INITIALIZE_GENERATION -!=============================================================================== - - subroutine initialize_generation() - - ! set overall generation number - overall_gen = gen_per_batch*(current_batch - 1) + current_gen - - ! Reset number of fission bank sites - n_bank = 0 - - ! Count source sites if using uniform fission source weighting - if (ufs) call count_source_for_ufs() - - ! Store current value of tracklength k - keff_generation = global_tallies(K_TRACKLENGTH) % value - - end subroutine initialize_generation - -!=============================================================================== -! FINALIZE_GENERATION -!=============================================================================== - - subroutine finalize_generation() - - ! Update global tallies with the omp private accumulation variables -!$omp parallel -!$omp critical - global_tallies(K_TRACKLENGTH) % value = & - global_tallies(K_TRACKLENGTH) % value + global_tally_tracklength - global_tallies(K_COLLISION) % value = & - global_tallies(K_COLLISION) % value + global_tally_collision - global_tallies(LEAKAGE) % value = & - global_tallies(LEAKAGE) % value + global_tally_leakage - global_tallies(K_ABSORPTION) % value = & - global_tallies(K_ABSORPTION) % value + global_tally_absorption -!$omp end critical - - ! reset private tallies - global_tally_tracklength = ZERO - global_tally_collision = ZERO - global_tally_leakage = ZERO - global_tally_absorption = ZERO -!$omp end parallel - -#ifdef _OPENMP - ! Join the fission bank from each thread into one global fission bank - call join_bank_from_threads() -#endif - - ! Distribute fission bank across processors evenly - call time_bank % start() - call synchronize_bank() - call time_bank % stop() - - ! Calculate shannon entropy - if (entropy_on) call shannon_entropy() - - ! Collect results and statistics - call calculate_generation_keff() - call calculate_average_keff() - - ! Write generation output - if (master .and. current_gen /= gen_per_batch) call print_generation() - - end subroutine finalize_generation - -!=============================================================================== -! FINALIZE_BATCH handles synchronization and accumulation of tallies, -! calculation of Shannon entropy, getting single-batch estimate of keff, and -! turning on tallies when appropriate -!=============================================================================== - - subroutine finalize_batch() - - ! Collect tallies - call time_tallies % start() - call synchronize_tallies() - call time_tallies % stop() - - ! Reset global tally results - if (.not. active_batches) then - call reset_result(global_tallies) - n_realizations = 0 - end if - - ! Perform CMFD calculation if on - if (cmfd_on) call execute_cmfd() - - ! Display output - if (master) call print_batch_keff() - - ! Calculate combined estimate of k-effective - if (master) call calculate_combined_keff() - - ! Check_triggers - if (master) call check_triggers() -#ifdef MPI - call MPI_BCAST(satisfy_triggers, 1, MPI_LOGICAL, 0, & - MPI_COMM_WORLD, mpi_err) -#endif - if (satisfy_triggers .or. & - (trigger_on .and. current_batch == n_max_batches)) then - call statepoint_batch % add(current_batch) - end if - - ! Write out state point if it's been specified for this batch - if (statepoint_batch % contains(current_batch)) then - call write_state_point() - end if - - ! Write out source point if it's been specified for this batch - if ((sourcepoint_batch % contains(current_batch) .or. source_latest) .and. & - source_write) then - call write_source_point() - end if - - if (master .and. current_batch == n_max_batches) then - ! Make sure combined estimate of k-effective is calculated at the last - ! batch in case no state point is written - call calculate_combined_keff() - end if - - end subroutine finalize_batch - !=============================================================================== ! SYNCHRONIZE_BANK samples source sites from the fission sites that were ! accumulated during the generation. This routine is what allows this Monte @@ -832,37 +581,6 @@ contains end subroutine count_source_for_ufs -!=============================================================================== -! REPLAY_BATCH_HISTORY displays keff and entropy for each generation within a -! batch using data read from a state point file -!=============================================================================== - - subroutine replay_batch_history - - ! Write message at beginning - if (current_batch == 1) then - call write_message("Replaying history from state point...", 1) - end if - - do current_gen = 1, gen_per_batch - overall_gen = overall_gen + 1 - call calculate_average_keff() - - ! print out batch keff - if (current_gen < gen_per_batch) then - if (master) call print_generation() - else - if (master) call print_batch_keff() - end if - end do - - ! Write message at end - if (current_batch == restart_batch) then - call write_message("Resuming simulation...", 1) - end if - - end subroutine replay_batch_history - #ifdef _OPENMP !=============================================================================== ! JOIN_BANK_FROM_THREADS diff --git a/src/fixed_source.F90 b/src/fixed_source.F90 deleted file mode 100644 index c0397fe0b..000000000 --- a/src/fixed_source.F90 +++ /dev/null @@ -1,142 +0,0 @@ -module fixed_source - -#ifdef MPI - use message_passing -#endif - - use constants, only: ZERO, MAX_LINE_LEN - use global - use output, only: write_message, header - use particle_header, only: Particle - use random_lcg, only: set_particle_seed - use source, only: initialize_source, get_source_particle - use state_point, only: write_state_point - use string, only: to_str - use tally, only: synchronize_tallies, setup_active_usertallies - use trigger, only: check_triggers - use tracking, only: transport - - implicit none - -contains - - subroutine run_fixedsource() - - type(Particle) :: p - integer(8) :: i_work ! index over histories in single cycle - - if (.not. restart_run) call initialize_source() - - if (master) call header("FIXED SOURCE TRANSPORT SIMULATION", level=1) - - ! Turn timer and tallies on - tallies_on = .true. -!$omp parallel - call setup_active_usertallies() -!$omp end parallel - call time_active % start() - - ! ========================================================================== - ! LOOP OVER BATCHES - BATCH_LOOP: do current_batch = 1, n_max_batches - - ! In a restart run, skip any batches that have already been simulated - if (restart_run .and. current_batch <= restart_batch) then - if (current_batch > n_inactive) n_realizations = n_realizations + 1 - cycle BATCH_LOOP - end if - - call initialize_batch() - overall_gen = current_batch - - ! Start timer for transport - call time_transport % start() - - ! ======================================================================= - ! LOOP OVER PARTICLES -!$omp parallel do schedule(static) firstprivate(p) - PARTICLE_LOOP: do i_work = 1, work - current_work = i_work - - ! grab source particle from bank - call get_source_particle(p, current_work) - - ! transport particle - call transport(p) - - end do PARTICLE_LOOP -!$omp end parallel do - - ! Accumulate time for transport - call time_transport % stop() - - call finalize_batch() - - if (satisfy_triggers) exit BATCH_LOOP - - end do BATCH_LOOP - - call time_active % stop() - - ! ========================================================================== - ! END OF RUN WRAPUP - - if (master) call header("SIMULATION FINISHED", level=1) - - end subroutine run_fixedsource - -!=============================================================================== -! INITIALIZE_BATCH -!=============================================================================== - - subroutine initialize_batch() - - call write_message("Simulating batch " // trim(to_str(current_batch)) & - &// "...", 1) - - ! Reset total starting particle weight used for normalizing tallies - total_weight = ZERO - - end subroutine initialize_batch - -!=============================================================================== -! FINALIZE_BATCH -!=============================================================================== - - subroutine finalize_batch() - -! Update global tallies with the omp private accumulation variables -!$omp parallel -!$omp critical - global_tallies(LEAKAGE) % value = & - global_tallies(LEAKAGE) % value + global_tally_leakage -!$omp end critical - - ! reset private tallies - global_tally_leakage = ZERO -!$omp end parallel - - ! Collect and accumulate tallies - call time_tallies % start() - call synchronize_tallies() - call time_tallies % stop() - - ! Check_triggers - if (master) call check_triggers() -#ifdef MPI - call MPI_BCAST(satisfy_triggers, 1, MPI_LOGICAL, 0, & - MPI_COMM_WORLD, mpi_err) -#endif - if (satisfy_triggers .or. & - (trigger_on .and. current_batch == n_max_batches)) then - call statepoint_batch % add(current_batch) - end if - - ! Write out state point if it's been specified for this batch - if (statepoint_batch % contains(current_batch)) then - call write_state_point() - end if - - end subroutine finalize_batch - -end module fixed_source diff --git a/src/main.F90 b/src/main.F90 index e4a33f009..aff1e2114 100644 --- a/src/main.F90 +++ b/src/main.F90 @@ -1,13 +1,12 @@ program main use constants - use eigenvalue, only: run_eigenvalue use finalize, only: finalize_run - use fixed_source, only: run_fixedsource use global use initialize, only: initialize_run use particle_restart, only: run_particle_restart use plot, only: run_plot + use simulation, only: run_simulation implicit none @@ -16,10 +15,8 @@ program main ! start problem based on mode select case (run_mode) - case (MODE_FIXEDSOURCE) - call run_fixedsource() - case (MODE_EIGENVALUE) - call run_eigenvalue() + case (MODE_FIXEDSOURCE, MODE_EIGENVALUE) + call run_simulation() case (MODE_PLOTTING) call run_plot() case (MODE_PARTICLE) diff --git a/src/simulation.F90 b/src/simulation.F90 new file mode 100644 index 000000000..64459f3fd --- /dev/null +++ b/src/simulation.F90 @@ -0,0 +1,325 @@ +module simulation + +#ifdef MPI + use mpi +#endif + + use cmfd_execute, only: cmfd_init_batch, execute_cmfd + use constants, only: ZERO + use eigenvalue, only: count_source_for_ufs, calculate_average_keff, & + calculate_combined_keff, calculate_generation_keff, & + shannon_entropy, synchronize_bank, keff_generation +#ifdef _OPENMP + use eigenvalue, only: join_bank_from_threads +#endif + use global + use output, only: write_message, header, print_columns, & + print_batch_keff, print_generation + use particle_header, only: Particle + use source, only: get_source_particle, initialize_source + use state_point, only: write_state_point, write_source_point + use string, only: to_str + use tally, only: synchronize_tallies, setup_active_usertallies, & + reset_result + use trigger, only: check_triggers + use tracking, only: transport + + implicit none + private + public :: run_simulation + +contains + +!=============================================================================== +! RUN_EIGENVALUE encompasses all the main logic where iterations are performed +! over the batches, generations, and histories in a k-eigenvalue calculation. +!=============================================================================== + + subroutine run_simulation() + + type(Particle) :: p + integer(8) :: i_work + + if (.not. restart_run) call initialize_source() + + ! Display header + if (master) then + if (run_mode == MODE_FIXEDSOURCE) then + call header("FIXED SOURCE TRANSPORT SIMULATION", level=1) + elseif (run_mode == MODE_EIGENVALUE) then + call header("K EIGENVALUE SIMULATION", level=1) + call print_columns() + end if + end if + + ! Turn on inactive timer + call time_inactive % start() + + ! ========================================================================== + ! LOOP OVER BATCHES + BATCH_LOOP: do current_batch = 1, n_max_batches + + call initialize_batch() + + ! Handle restart runs + if (restart_run .and. current_batch <= restart_batch) then + call replay_batch_history() + cycle BATCH_LOOP + end if + + ! ======================================================================= + ! LOOP OVER GENERATIONS + GENERATION_LOOP: do current_gen = 1, gen_per_batch + + call initialize_generation() + + ! Start timer for transport + call time_transport % start() + + ! ==================================================================== + ! LOOP OVER PARTICLES +!$omp parallel do schedule(static) firstprivate(p) + PARTICLE_LOOP: do i_work = 1, work + current_work = i_work + + ! grab source particle from bank + call get_source_particle(p, current_work) + + ! transport particle + call transport(p) + + end do PARTICLE_LOOP +!$omp end parallel do + + ! Accumulate time for transport + call time_transport % stop() + + call finalize_generation() + + end do GENERATION_LOOP + + call finalize_batch() + + if (satisfy_triggers) exit BATCH_LOOP + + end do BATCH_LOOP + + call time_active % stop() + + ! ========================================================================== + ! END OF RUN WRAPUP + + if (master) call header("SIMULATION FINISHED", level=1) + + ! Clear particle + call p % clear() + + end subroutine run_simulation + +!=============================================================================== +! INITIALIZE_BATCH +!=============================================================================== + + subroutine initialize_batch() + + if (run_mode == MODE_FIXEDSOURCE) then + call write_message("Simulating batch " // trim(to_str(current_batch)) & + // "...", 1) + end if + + ! Reset total starting particle weight used for normalizing tallies + total_weight = ZERO + + if (current_batch == n_inactive + 1) then + ! Switch from inactive batch timer to active batch timer + call time_inactive % stop() + call time_active % start() + + ! Enable active batches (and tallies_on if it hasn't been enabled) + active_batches = .true. + tallies_on = .true. + + ! Add user tallies to active tallies list +!$omp parallel + call setup_active_usertallies() +!$omp end parallel + end if + + ! check CMFD initialize batch + if (run_mode == MODE_EIGENVALUE) then + if (cmfd_run) call cmfd_init_batch() + end if + + end subroutine initialize_batch + +!=============================================================================== +! INITIALIZE_GENERATION +!=============================================================================== + + subroutine initialize_generation() + + ! set overall generation number + overall_gen = gen_per_batch*(current_batch - 1) + current_gen + + if (run_mode == MODE_EIGENVALUE) then + ! Reset number of fission bank sites + n_bank = 0 + + ! Count source sites if using uniform fission source weighting + if (ufs) call count_source_for_ufs() + + ! Store current value of tracklength k + keff_generation = global_tallies(K_TRACKLENGTH) % value + end if + + end subroutine initialize_generation + +!=============================================================================== +! FINALIZE_GENERATION +!=============================================================================== + + subroutine finalize_generation() + + ! Update global tallies with the omp private accumulation variables +!$omp parallel +!$omp critical + if (run_mode == MODE_EIGENVALUE) then + global_tallies(K_COLLISION) % value = & + global_tallies(K_COLLISION) % value + global_tally_collision + global_tallies(K_ABSORPTION) % value = & + global_tallies(K_ABSORPTION) % value + global_tally_absorption + global_tallies(K_TRACKLENGTH) % value = & + global_tallies(K_TRACKLENGTH) % value + global_tally_tracklength + end if + global_tallies(LEAKAGE) % value = & + global_tallies(LEAKAGE) % value + global_tally_leakage +!$omp end critical + + ! reset private tallies + if (run_mode == MODE_EIGENVALUE) then + global_tally_collision = 0 + global_tally_absorption = 0 + global_tally_tracklength = 0 + end if + global_tally_leakage = 0 +!$omp end parallel + + if (run_mode == MODE_EIGENVALUE) then +#ifdef _OPENMP + ! Join the fission bank from each thread into one global fission bank + call join_bank_from_threads() +#endif + + ! Distribute fission bank across processors evenly + call time_bank % start() + call synchronize_bank() + call time_bank % stop() + + ! Calculate shannon entropy + if (entropy_on) call shannon_entropy() + + ! Collect results and statistics + call calculate_generation_keff() + call calculate_average_keff() + + ! Write generation output + if (master .and. current_gen /= gen_per_batch) call print_generation() + end if + + end subroutine finalize_generation + +!=============================================================================== +! FINALIZE_BATCH handles synchronization and accumulation of tallies, +! calculation of Shannon entropy, getting single-batch estimate of keff, and +! turning on tallies when appropriate +!=============================================================================== + + subroutine finalize_batch() + + ! Collect tallies + call time_tallies % start() + call synchronize_tallies() + call time_tallies % stop() + + ! Reset global tally results + if (.not. active_batches) then + call reset_result(global_tallies) + n_realizations = 0 + end if + + if (run_mode == MODE_EIGENVALUE) then + ! Perform CMFD calculation if on + if (cmfd_on) call execute_cmfd() + + ! Display output + if (master) call print_batch_keff() + + ! Calculate combined estimate of k-effective + if (master) call calculate_combined_keff() + end if + + ! Check_triggers + if (master) call check_triggers() +#ifdef MPI + call MPI_BCAST(satisfy_triggers, 1, MPI_LOGICAL, 0, & + MPI_COMM_WORLD, mpi_err) +#endif + if (satisfy_triggers .or. & + (trigger_on .and. current_batch == n_max_batches)) then + call statepoint_batch % add(current_batch) + end if + + ! Write out state point if it's been specified for this batch + if (statepoint_batch % contains(current_batch)) then + call write_state_point() + end if + + ! Write out source point if it's been specified for this batch + if ((sourcepoint_batch % contains(current_batch) .or. source_latest) .and. & + source_write) then + call write_source_point() + end if + + if (master .and. current_batch == n_max_batches .and. & + run_mode == MODE_EIGENVALUE) then + ! Make sure combined estimate of k-effective is calculated at the last + ! batch in case no state point is written + call calculate_combined_keff() + end if + + end subroutine finalize_batch + +!=============================================================================== +! REPLAY_BATCH_HISTORY displays keff and entropy for each generation within a +! batch using data read from a state point file +!=============================================================================== + + subroutine replay_batch_history + + ! Write message at beginning + if (current_batch == 1) then + call write_message("Replaying history from state point...", 1) + end if + + if (run_mode == MODE_EIGENVALUE) then + do current_gen = 1, gen_per_batch + overall_gen = overall_gen + 1 + call calculate_average_keff() + + ! print out batch keff + if (current_gen < gen_per_batch) then + if (master) call print_generation() + else + if (master) call print_batch_keff() + end if + end do + end if + + ! Write message at end + if (current_batch == restart_batch) then + call write_message("Resuming simulation...", 1) + end if + + end subroutine replay_batch_history + +end module simulation diff --git a/tests/test_particle_restart_fixed/results_true.dat b/tests/test_particle_restart_fixed/results_true.dat index 81aed707c..701c3e133 100644 --- a/tests/test_particle_restart_fixed/results_true.dat +++ b/tests/test_particle_restart_fixed/results_true.dat @@ -1,7 +1,7 @@ current batch: 7.000000E+00 current gen: -0.000000E+00 +1.000000E+00 particle id: 9.280000E+02 run mode: From 6791b43b2b71fc3f7e666e841555726e46b3f4ff Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Thu, 2 Jul 2015 20:10:41 +0700 Subject: [PATCH 30/43] Don't show eigenvalue-related timing information for fixed source runs --- src/output.F90 | 12 ++++++++---- 1 file changed, 8 insertions(+), 4 deletions(-) diff --git a/src/output.F90 b/src/output.F90 index 939451c6f..d1d4ec72a 100644 --- a/src/output.F90 +++ b/src/output.F90 @@ -1547,11 +1547,15 @@ contains write(ou,100) "Total time in simulation", time_inactive % elapsed + & time_active % elapsed write(ou,100) " Time in transport only", time_transport % elapsed - write(ou,100) " Time in inactive batches", time_inactive % elapsed + if (run_mode == MODE_EIGENVALUE) then + write(ou,100) " Time in inactive batches", time_inactive % elapsed + end if write(ou,100) " Time in active batches", time_active % elapsed - write(ou,100) " Time synchronizing fission bank", time_bank % elapsed - write(ou,100) " Sampling source sites", time_bank_sample % elapsed - write(ou,100) " SEND/RECV source sites", time_bank_sendrecv % elapsed + if (run_mode == MODE_EIGENVALUE) then + write(ou,100) " Time synchronizing fission bank", time_bank % elapsed + write(ou,100) " Sampling source sites", time_bank_sample % elapsed + write(ou,100) " SEND/RECV source sites", time_bank_sendrecv % elapsed + end if write(ou,100) " Time accumulating tallies", time_tallies % elapsed if (cmfd_run) write(ou,100) " Time in CMFD", time_cmfd % elapsed if (cmfd_run) write(ou,100) " Building matrices", & From 68dcbab15f073a05693a01b7885bfdf6d445b035 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Wed, 15 Jul 2015 14:35:30 +0200 Subject: [PATCH 31/43] Implement secondary particle bank capability --- src/constants.F90 | 3 ++ src/particle_header.F90 | 32 ++++++++++++++++++- src/simulation.F90 | 49 +++++++++++++++++++++++++++-- src/source.F90 | 70 ----------------------------------------- src/tracking.F90 | 39 +++++++++++++---------- 5 files changed, 104 insertions(+), 89 deletions(-) diff --git a/src/constants.F90 b/src/constants.F90 index 3aaf08f0e..38bedf022 100644 --- a/src/constants.F90 +++ b/src/constants.F90 @@ -44,6 +44,9 @@ module constants integer, parameter :: MAX_EVENTS = 10000 integer, parameter :: MAX_SAMPLE = 100000 + ! Maximum number of secondary particles created + integer, parameter :: MAX_SECONDARY = 1000 + ! Maximum number of words in a single line, length of line, and length of ! single word integer, parameter :: MAX_WORDS = 500 diff --git a/src/particle_header.F90 b/src/particle_header.F90 index 7c2586c3e..ba712b1d3 100644 --- a/src/particle_header.F90 +++ b/src/particle_header.F90 @@ -1,6 +1,7 @@ module particle_header - use constants, only: NEUTRON, ONE, NONE, ZERO + use bank_header, only: Bank + use constants, only: NEUTRON, ONE, NONE, ZERO, MAX_SECONDARY use geometry_header, only: BASE_UNIVERSE implicit none @@ -79,9 +80,14 @@ module particle_header ! Track output logical :: write_track = .false. + ! Secondary particles created + integer :: n_secondary = 0 + type(Bank) :: secondary_bank(MAX_SECONDARY) + contains procedure :: initialize => initialize_particle procedure :: clear => clear_particle + procedure :: initialize_from_source => initialize_from_source end type Particle contains @@ -114,6 +120,7 @@ contains this % wgt_bank = ZERO this % n_collision = 0 this % fission = .false. + this % n_secondary = 0 ! Set up base level coordinates this % coord(1) % universe = BASE_UNIVERSE @@ -154,4 +161,27 @@ contains end subroutine reset_coord +!=============================================================================== +! INITIALIZE_FROM_SOURCE +!=============================================================================== + + subroutine initialize_from_source(this, src) + class(Particle), intent(inout) :: this + type(Bank), intent(in) :: src + + ! set defaults + call this % initialize() + + ! copy attributes from source bank site + this % wgt = src % wgt + this % last_wgt = src % wgt + this % coord(1) % xyz = src % xyz + this % coord(1) % uvw = src % uvw + this % last_xyz = src % xyz + this % last_uvw = src % uvw + this % E = src % E + this % last_E = src % E + + end subroutine initialize_from_source + end module particle_header diff --git a/src/simulation.F90 b/src/simulation.F90 index 64459f3fd..ab9b42248 100644 --- a/src/simulation.F90 +++ b/src/simulation.F90 @@ -16,7 +16,8 @@ module simulation use output, only: write_message, header, print_columns, & print_batch_keff, print_generation use particle_header, only: Particle - use source, only: get_source_particle, initialize_source + use random_lcg, only: set_particle_seed + use source, only: initialize_source use state_point, only: write_state_point, write_source_point use string, only: to_str use tally, only: synchronize_tallies, setup_active_usertallies, & @@ -83,7 +84,7 @@ contains current_work = i_work ! grab source particle from bank - call get_source_particle(p, current_work) + call initialize_history(p, current_work) ! transport particle call transport(p) @@ -116,6 +117,50 @@ contains end subroutine run_simulation +!=============================================================================== +! INITIALIZE_HISTORY +!=============================================================================== + + subroutine initialize_history(p, index_source) + + type(Particle), intent(inout) :: p + integer(8), intent(in) :: index_source + + integer(8) :: particle_seed ! unique index for particle + integer :: i + + ! set defaults + call p % initialize_from_source(source_bank(index_source)) + + ! set identifier for particle + p % id = work_index(rank) + index_source + + ! set random number seed + particle_seed = (overall_gen - 1)*n_particles + p % id + call set_particle_seed(particle_seed) + + ! set particle trace + trace = .false. + if (current_batch == trace_batch .and. current_gen == trace_gen .and. & + p % id == trace_particle) trace = .true. + + ! Set particle track. + p % write_track = .false. + if (write_all_tracks) then + p % write_track = .true. + else if (allocated(track_identifiers)) then + do i=1, size(track_identifiers(1,:)) + if (current_batch == track_identifiers(1,i) .and. & + ¤t_gen == track_identifiers(2,i) .and. & + &p % id == track_identifiers(3,i)) then + p % write_track = .true. + exit + end if + end do + end if + + end subroutine initialize_history + !=============================================================================== ! INITIALIZE_BATCH !=============================================================================== diff --git a/src/source.F90 b/src/source.F90 index 04b5ac760..32be6069c 100644 --- a/src/source.F90 +++ b/src/source.F90 @@ -245,74 +245,4 @@ contains end subroutine sample_external_source -!=============================================================================== -! GET_SOURCE_PARTICLE returns the next source particle -!=============================================================================== - - subroutine get_source_particle(p, index_source) - - type(Particle), intent(inout) :: p - integer(8), intent(in) :: index_source - - integer(8) :: particle_seed ! unique index for particle - integer :: i - type(Bank), pointer :: src - - ! set defaults - call p % initialize() - - ! Copy attributes from source to particle - src => source_bank(index_source) - call copy_source_attributes(p, src) - - ! set identifier for particle - p % id = work_index(rank) + index_source - - ! set random number seed - particle_seed = (overall_gen - 1)*n_particles + p % id - call set_particle_seed(particle_seed) - - ! set particle trace - trace = .false. - if (current_batch == trace_batch .and. current_gen == trace_gen .and. & - p % id == trace_particle) trace = .true. - - ! Set particle track. - p % write_track = .false. - if (write_all_tracks) then - p % write_track = .true. - else if (allocated(track_identifiers)) then - do i=1, size(track_identifiers(1,:)) - if (current_batch == track_identifiers(1,i) .and. & - ¤t_gen == track_identifiers(2,i) .and. & - &p % id == track_identifiers(3,i)) then - p % write_track = .true. - exit - end if - end do - end if - - end subroutine get_source_particle - -!=============================================================================== -! COPY_SOURCE_ATTRIBUTES -!=============================================================================== - - subroutine copy_source_attributes(p, src) - - type(Particle), intent(inout) :: p - type(Bank), pointer :: src - - ! copy attributes from source bank site - p % wgt = src % wgt - p % last_wgt = src % wgt - p % coord(1) % xyz = src % xyz - p % coord(1) % uvw = src % uvw - p % last_xyz = src % xyz - p % last_uvw = src % uvw - p % E = src % E - p % last_E = src % E - - end subroutine copy_source_attributes - end module source diff --git a/src/tracking.F90 b/src/tracking.F90 index e5faeb209..ba452a014 100644 --- a/src/tracking.F90 +++ b/src/tracking.F90 @@ -45,20 +45,6 @@ contains call write_message("Simulating Particle " // trim(to_str(p % id))) end if - ! If the cell hasn't been determined based on the particle's location, - ! initiate a search for the current cell - if (p % coord(p % n_coord) % cell == NONE) then - call find_cell(p, found_cell) - - ! Particle couldn't be located - if (.not. found_cell) then - call fatal_error("Could not locate particle " // trim(to_str(p % id))) - end if - - ! set birth cell attribute - p % cell_born = p % coord(p % n_coord) % cell - end if - ! Initialize number of events to zero n_event = 0 @@ -74,7 +60,19 @@ contains call initialize_particle_track() endif - do while (p % alive) + EVENT_LOOP: do + ! If the cell hasn't been determined based on the particle's location, + ! initiate a search for the current cell. This generally happens at the + ! beginning of the history and again for any secondary particles + if (p % coord(p % n_coord) % cell == NONE) then + call find_cell(p, found_cell) + if (.not. found_cell) then + call fatal_error("Could not locate particle " // trim(to_str(p % id))) + end if + + ! set birth cell attribute + if (p % cell_born == NONE) p % cell_born = p % coord(p % n_coord) % cell + end if ! Write particle track. if (p % write_track) call write_particle_track(p) @@ -197,7 +195,16 @@ contains p % alive = .false. end if - end do + ! Check for secondary particles if this particle is dead + if (.not. p % alive) then + if (p % n_secondary > 0) then + call p % initialize_from_source(p % secondary_bank(p % n_secondary)) + p % n_secondary = p % n_secondary - 1 + else + exit EVENT_LOOP + end if + end if + end do EVENT_LOOP ! Finish particle track output. if (p % write_track) then From 3da9bcf32573a263ebca81eb1b0f86e3ddb255f3 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Thu, 16 Jul 2015 10:56:21 +0200 Subject: [PATCH 32/43] Create secondary neutrons for inelastic reactions with integral multiplicity. --- src/particle_header.F90 | 24 ++++++++++++++++++++-- src/physics.F90 | 44 ++++++++++++++++++++++------------------- 2 files changed, 46 insertions(+), 22 deletions(-) diff --git a/src/particle_header.F90 b/src/particle_header.F90 index ba712b1d3..9164845e8 100644 --- a/src/particle_header.F90 +++ b/src/particle_header.F90 @@ -87,7 +87,8 @@ module particle_header contains procedure :: initialize => initialize_particle procedure :: clear => clear_particle - procedure :: initialize_from_source => initialize_from_source + procedure :: initialize_from_source + procedure :: create_secondary end type Particle contains @@ -120,7 +121,6 @@ contains this % wgt_bank = ZERO this % n_collision = 0 this % fission = .false. - this % n_secondary = 0 ! Set up base level coordinates this % coord(1) % universe = BASE_UNIVERSE @@ -184,4 +184,24 @@ contains end subroutine initialize_from_source +!=============================================================================== +! CREATE_SECONDARY +!=============================================================================== + + subroutine create_secondary(this, uvw, type) + class(Particle), intent(inout) :: this + real(8), intent(in) :: uvw(3) + integer, intent(in) :: type + + integer :: n + + n = this % n_secondary + 1 + this % secondary_bank(n) % wgt = this % wgt + this % secondary_bank(n) % xyz(:) = this % coord(1) % xyz + this % secondary_bank(n) % uvw(:) = uvw + this % secondary_bank(n) % E = this % E + this % n_secondary = n + + end subroutine create_secondary + end module particle_header diff --git a/src/physics.F90 b/src/physics.F90 index 9ca59a987..11bc3720f 100644 --- a/src/physics.F90 +++ b/src/physics.F90 @@ -382,8 +382,7 @@ contains end do ! Perform collision physics for inelastic scattering - call inelastic_scatter(nuc, rxn, p % E, p % coord(1) % uvw, & - p % mu, p % wgt) + call inelastic_scatter(nuc, rxn, p) p % event_MT = rxn % MT end if @@ -1268,24 +1267,23 @@ contains ! than fission), i.e. level scattering, (n,np), (n,na), etc. !=============================================================================== - subroutine inelastic_scatter(nuc, rxn, E, uvw, mu, wgt) + subroutine inelastic_scatter(nuc, rxn, p) + type(Nuclide), pointer :: nuc + type(Reaction), pointer :: rxn + type(Particle), intent(inout) :: p - type(Nuclide), pointer :: nuc - type(Reaction), pointer :: rxn - real(8), intent(inout) :: E ! energy in lab (incoming/outgoing) - real(8), intent(inout) :: uvw(3) ! directional cosines - real(8), intent(out) :: mu ! cosine of scattering angle in lab - real(8), intent(inout) :: wgt ! particle weight - - integer :: law ! secondary energy distribution law - real(8) :: A ! atomic weight ratio of nuclide - real(8) :: E_in ! incoming energy - real(8) :: E_cm ! outgoing energy in center-of-mass - real(8) :: Q ! Q-value of reaction - real(8) :: yield ! neutron yield + integer :: i ! loop index + integer :: law ! secondary energy distribution law + real(8) :: E ! energy in lab (incoming/outgoing) + real(8) :: mu ! cosine of scattering angle in lab + real(8) :: A ! atomic weight ratio of nuclide + real(8) :: E_in ! incoming energy + real(8) :: E_cm ! outgoing energy in center-of-mass + real(8) :: Q ! Q-value of reaction + real(8) :: yield ! neutron yield ! copy energy of neutron - E_in = E + E_in = p % E ! determine A and Q A = nuc % awr @@ -1319,16 +1317,22 @@ contains mu = mu * sqrt(E_cm/E) + ONE/(A+ONE) * sqrt(E_in/E) end if + ! Set outgoing energy and scattering angle + p % E = E + p % mu = mu + ! change direction of particle - uvw = rotate_angle(uvw, mu) + p % coord(1) % uvw = rotate_angle(p % coord(1) % uvw, mu) ! change weight of particle based on yield if (rxn % multiplicity_with_E) then yield = interpolate_tab1(rxn % multiplicity_E, E_in) + p % wgt = yield * p % wgt else - yield = rxn % multiplicity + do i = 1, rxn % multiplicity - 1 + call p % create_secondary(p % coord(1) % uvw, NEUTRON) + end do end if - wgt = yield * wgt end subroutine inelastic_scatter From 23481c64384d147388afe684a4d8c269364823e1 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Thu, 16 Jul 2015 22:05:41 +0400 Subject: [PATCH 33/43] Update test results since modeling (n,xn) as secondary particles changes answers --- CMakeLists.txt | 4 +- tests/test_basic/results_true.dat | 2 +- tests/test_cmfd_feed/results_true.dat | 500 +- tests/test_cmfd_nofeed/results_true.dat | 502 +- tests/test_density_atombcm/results_true.dat | 2 +- tests/test_density_atomcm3/results_true.dat | 2 +- tests/test_density_kgm3/results_true.dat | 2 +- tests/test_density_sum/results_true.dat | 2 +- .../results_true.dat | 2 +- .../results_true.dat | 2 +- tests/test_energy_grid/results_true.dat | 2 +- tests/test_entropy/results_true.dat | 16 +- tests/test_filter_cell/results_true.dat | 14 +- tests/test_filter_cellborn/results_true.dat | 6 +- tests/test_filter_energy/results_true.dat | 18 +- tests/test_filter_energyout/results_true.dat | 18 +- .../results_true.dat | 66 +- tests/test_filter_material/results_true.dat | 18 +- tests/test_filter_mesh_2d/results_true.dat | 590 +-- tests/test_filter_mesh_3d/results_true.dat | 1634 +++---- tests/test_filter_universe/results_true.dat | 18 +- tests/test_infinite_cell/results_true.dat | 2 +- tests/test_lattice_mixed/results_true.dat | 2 +- tests/test_lattice_multiple/results_true.dat | 2 +- tests/test_many_scores/results_true.dat | 214 +- tests/test_natural_element/results_true.dat | 2 +- tests/test_output/results_true.dat | 2 +- .../results_true.dat | 10 +- .../test_particle_restart_eigval.py | 2 +- tests/test_ptables_off/results_true.dat | 2 +- tests/test_reflective_cone/results_true.dat | 2 +- .../test_reflective_cylinder/results_true.dat | 2 +- tests/test_reflective_plane/results_true.dat | 2 +- tests/test_reflective_sphere/results_true.dat | 2 +- .../results_true.dat | 2 +- tests/test_rotation/results_true.dat | 2 +- tests/test_salphabeta/results_true.dat | 2 +- .../test_salphabeta_multiple/results_true.dat | 2 +- tests/test_score_MT/results_true.dat | 42 +- tests/test_score_absorption/results_true.dat | 22 +- tests/test_score_current/results_true.dat | 2 +- tests/test_score_events/results_true.dat | 18 +- tests/test_score_fission/results_true.dat | 18 +- tests/test_score_flux/results_true.dat | 26 +- tests/test_score_flux_yn/results_true.dat | 890 ++-- .../test_score_kappafission/results_true.dat | 10 +- tests/test_score_nufission/results_true.dat | 10 +- tests/test_score_nuscatter/results_true.dat | 14 +- tests/test_score_nuscatter_n/results_true.dat | 62 +- .../test_score_nuscatter_pn/results_true.dat | 42 +- .../test_score_nuscatter_yn/results_true.dat | 70 +- tests/test_score_scatter/results_true.dat | 14 +- tests/test_score_scatter_n/results_true.dat | 62 +- tests/test_score_scatter_pn/results_true.dat | 42 +- tests/test_score_scatter_yn/results_true.dat | 106 +- tests/test_score_total/results_true.dat | 14 +- tests/test_score_total_yn/results_true.dat | 414 +- tests/test_seed/results_true.dat | 2 +- tests/test_source_angle_mono/results_true.dat | 2 +- .../results_true.dat | 2 +- .../test_source_energy_mono/results_true.dat | 2 +- tests/test_source_file/results_true.dat | 2 +- tests/test_source_point/results_true.dat | 2 +- .../test_sourcepoint_latest/results_true.dat | 2 +- .../test_sourcepoint_restart/results_true.dat | 3960 ++++++++-------- tests/test_statepoint_batch/results_true.dat | 2 +- .../test_statepoint_interval/results_true.dat | 2 +- .../test_statepoint_restart/results_true.dat | 4208 ++++++++--------- .../results_true.dat | 2 +- tests/test_survival_biasing/results_true.dat | 2 +- tests/test_tally_assumesep/results_true.dat | 14 +- tests/test_trace/results_true.dat | 2 +- tests/test_translation/results_true.dat | 2 +- .../results_true.dat | 50 +- .../test_trigger_batch_interval/settings.xml | 6 +- .../test_trigger_batch_interval.py | 2 +- .../results_true.dat | 50 +- .../settings.xml | 6 +- .../test_trigger_no_batch_interval.py | 2 +- tests/test_trigger_no_status/results_true.dat | 50 +- tests/test_trigger_tallies/results_true.dat | 50 +- tests/test_trigger_tallies/settings.xml | 4 +- tests/test_uniform_fs/results_true.dat | 2 +- .../test_union_energy_grids/results_true.dat | 2 +- tests/test_universe/results_true.dat | 2 +- tests/test_void/results_true.dat | 2 +- 86 files changed, 6994 insertions(+), 6994 deletions(-) diff --git a/CMakeLists.txt b/CMakeLists.txt index b6bafd546..fd122a14c 100644 --- a/CMakeLists.txt +++ b/CMakeLists.txt @@ -315,7 +315,7 @@ foreach(test ${TESTS}) elseif(${test} MATCHES "test_sourcepoint_restart") set(RESTART_FILE statepoint.07.h5 source.07.h5) elseif(${test} MATCHES "test_particle_restart_eigval") - set(RESTART_FILE particle_12_616.h5) + set(RESTART_FILE particle_9_555.h5) elseif(${test} MATCHES "test_particle_restart_fixed") set(RESTART_FILE particle_7_928.h5) else(${test} MATCHES "test_statepoint_restart") @@ -330,7 +330,7 @@ foreach(test ${TESTS}) elseif(${test} MATCHES "test_sourcepoint_restart") set(RESTART_FILE statepoint.07.binary source.07.binary) elseif(${test} MATCHES "test_particle_restart_eigval") - set(RESTART_FILE particle_12_616.binary) + set(RESTART_FILE particle_9_555.binary) elseif(${test} MATCHES "test_particle_restart_fixed") set(RESTART_FILE particle_7_6144.binary) else(${test} MATCHES "test_statepoint_restart") diff --git a/tests/test_basic/results_true.dat b/tests/test_basic/results_true.dat index f2dfdeca1..5263a6b7f 100644 --- a/tests/test_basic/results_true.dat +++ b/tests/test_basic/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.011726E-01 1.841644E-03 +3.021779E-01 3.813358E-03 diff --git a/tests/test_cmfd_feed/results_true.dat b/tests/test_cmfd_feed/results_true.dat index a1dd0d815..26380d403 100644 --- a/tests/test_cmfd_feed/results_true.dat +++ b/tests/test_cmfd_feed/results_true.dat @@ -1,128 +1,128 @@ k-combined: -1.177396E+00 4.883437E-03 +1.172666E+00 8.502438E-03 tally 1: -1.107335E+01 -1.235221E+01 -2.002676E+01 -4.017045E+01 -2.844184E+01 -8.111731E+01 -3.428492E+01 -1.177848E+02 -3.735839E+01 -1.397523E+02 -3.894180E+01 -1.517824E+02 -3.528006E+01 -1.246308E+02 -2.863448E+01 -8.222321E+01 -2.125384E+01 -4.535192E+01 -1.112124E+01 -1.241089E+01 +1.170812E+01 +1.376785E+01 +2.179886E+01 +4.765478E+01 +2.945614E+01 +8.709999E+01 +3.527293E+01 +1.245879E+02 +3.829349E+01 +1.470691E+02 +3.709040E+01 +1.379455E+02 +3.380335E+01 +1.145311E+02 +2.801351E+01 +7.871047E+01 +2.029625E+01 +4.131602E+01 +1.084302E+01 +1.180329E+01 tally 2: -2.243113E+01 -2.535057E+01 -1.557550E+01 -1.222813E+01 -2.164704E+00 -2.389690E-01 -4.049814E+01 -8.218116E+01 -2.854669E+01 -4.085264E+01 -3.934452E+00 -7.833208E-01 -5.706024E+01 -1.633739E+02 -4.049737E+01 -8.234850E+01 -5.231368E+00 -1.386110E+00 -6.798682E+01 -2.320807E+02 -4.819178E+01 -1.166820E+02 -6.247056E+00 -1.968990E+00 -7.449317E+01 -2.782374E+02 -5.315156E+01 -1.417287E+02 -6.667584E+00 -2.250879E+00 -7.530107E+01 -2.849330E+02 -5.378916E+01 -1.454619E+02 -7.071012E+00 -2.522919E+00 -6.820303E+01 -2.335083E+02 -4.850330E+01 -1.181013E+02 -6.241747E+00 -1.973368E+00 -5.831373E+01 -1.704779E+02 -4.149124E+01 -8.633656E+01 -5.385636E+00 -1.468642E+00 -4.184350E+01 -8.792430E+01 -2.971699E+01 -4.435896E+01 -3.784806E+00 -7.343249E-01 -2.202673E+01 -2.444732E+01 -1.531988E+01 -1.183160E+01 -2.073873E+00 -2.272561E-01 +2.270565E+01 +2.599927E+01 +1.590852E+01 +1.276260E+01 +2.252857E+00 +2.614120E-01 +4.313167E+01 +9.326539E+01 +3.044479E+01 +4.648169E+01 +4.023051E+00 +8.172006E-01 +5.859113E+01 +1.725665E+02 +4.171599E+01 +8.755981E+01 +5.512216E+00 +1.531207E+00 +6.892516E+01 +2.383198E+02 +4.904413E+01 +1.207096E+02 +6.542718E+00 +2.155749E+00 +7.421495E+01 +2.764539E+02 +5.288881E+01 +1.405388E+02 +6.811354E+00 +2.358827E+00 +7.278191E+01 +2.661597E+02 +5.169924E+01 +1.343999E+02 +6.516967E+00 +2.148745E+00 +6.655238E+01 +2.222812E+02 +4.729758E+01 +1.123214E+02 +6.102046E+00 +1.890147E+00 +5.708495E+01 +1.636585E+02 +4.068603E+01 +8.317681E+01 +5.394757E+00 +1.465413E+00 +4.136562E+01 +8.598520E+01 +2.958591E+01 +4.402226E+01 +3.765802E+00 +7.200302E-01 +2.275517E+01 +2.614738E+01 +1.589295E+01 +1.276624E+01 +2.232715E+00 +2.558645E-01 tally 3: -1.500439E+01 -1.135466E+01 -9.942586E-01 -5.051831E-02 -2.744453E+01 -3.776958E+01 -1.781992E+00 -1.612021E-01 -3.901013E+01 -7.642401E+01 -2.472924E+00 -3.077607E-01 -4.642527E+01 -1.082730E+02 -2.924369E+00 -4.335819E-01 -5.109083E+01 -1.309660E+02 -3.325865E+00 -5.592642E-01 -5.182512E+01 -1.350762E+02 -3.259912E+00 -5.350517E-01 -4.672480E+01 -1.095974E+02 -3.097309E+00 -4.854729E-01 -3.997405E+01 -8.014326E+01 -2.589176E+00 -3.374615E-01 -2.861624E+01 -4.114210E+01 -1.806237E+00 -1.656944E-01 -1.474531E+01 -1.096355E+01 -9.807860E-01 -4.934364E-02 +1.529144E+01 +1.179942E+01 +1.023883E+00 +5.386625E-02 +2.936854E+01 +4.326483E+01 +1.881629E+00 +1.788063E-01 +4.015056E+01 +8.114284E+01 +2.594958E+00 +3.407980E-01 +4.720593E+01 +1.118311E+02 +3.161769E+00 +5.053887E-01 +5.095790E+01 +1.304930E+02 +3.308202E+00 +5.528151E-01 +4.979520E+01 +1.246892E+02 +3.163884E+00 +5.062497E-01 +4.554330E+01 +1.041770E+02 +3.019145E+00 +4.618487E-01 +3.921119E+01 +7.727273E+01 +2.472070E+00 +3.099171E-01 +2.843166E+01 +4.067093E+01 +1.823607E+00 +1.688171E-01 +1.530477E+01 +1.184246E+01 +1.047996E+00 +5.549017E-02 tally 4: 0.000000E+00 0.000000E+00 @@ -160,8 +160,8 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -3.050887E+00 -4.698799E-01 +3.111592E+00 +4.883699E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -208,10 +208,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -5.388951E+00 -1.456464E+00 -2.664528E+00 -3.577345E-01 +5.536088E+00 +1.540676E+00 +2.727975E+00 +3.757452E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -256,10 +256,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -7.165280E+00 -2.573230E+00 -4.930263E+00 -1.218988E+00 +7.518115E+00 +2.840502E+00 +5.271874E+00 +1.398895E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -304,10 +304,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -8.550278E+00 -3.668687E+00 -6.985934E+00 -2.450395E+00 +8.764240E+00 +3.855378E+00 +7.176540E+00 +2.591613E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -352,10 +352,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -9.236725E+00 -4.281659E+00 -8.429932E+00 -3.565265E+00 +9.381092E+00 +4.414024E+00 +8.597689E+00 +3.710217E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -400,10 +400,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -9.396613E+00 -4.431004E+00 -9.307625E+00 -4.351276E+00 +9.158655E+00 +4.215178E+00 +9.188880E+00 +4.244766E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -448,10 +448,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -8.721885E+00 -3.821463E+00 -9.438995E+00 -4.479948E+00 +8.362511E+00 +3.509173E+00 +9.159213E+00 +4.209143E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -496,10 +496,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -7.096946E+00 -2.525113E+00 -8.605114E+00 -3.710134E+00 +7.029505E+00 +2.479106E+00 +8.613258E+00 +3.719199E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -544,10 +544,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -5.222832E+00 -1.373166E+00 -7.480684E+00 -2.804650E+00 +5.119892E+00 +1.320586E+00 +7.401001E+00 +2.749355E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -592,10 +592,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -2.726690E+00 -3.773397E-01 -5.470375E+00 -1.504111E+00 +2.765680E+00 +3.903229E-01 +5.461998E+00 +1.501206E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -642,8 +642,8 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -3.026290E+00 -4.597502E-01 +3.044921E+00 +4.656739E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -662,114 +662,114 @@ k cmfd 0.000000E+00 0.000000E+00 0.000000E+00 -1.150583E+00 -1.159578E+00 -1.162798E+00 -1.171003E+00 -1.162732E+00 -1.165591E+00 -1.166032E+00 -1.165387E+00 -1.165451E+00 -1.170726E+00 -1.170820E+00 -1.167945E+00 -1.166050E+00 -1.165757E+00 -1.167631E+00 -1.168366E+00 +1.177990E+00 +1.160010E+00 +1.155990E+00 +1.160167E+00 +1.162166E+00 +1.161566E+00 +1.164454E+00 +1.166269E+00 +1.168529E+00 +1.168622E+00 +1.170296E+00 +1.168644E+00 +1.172975E+00 +1.176543E+00 +1.173389E+00 +1.178422E+00 cmfd entropy 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -3.215201E+00 -3.212850E+00 -3.214094E+00 -3.208054E+00 -3.212891E+00 -3.213349E+00 -3.208290E+00 -3.206895E+00 -3.208786E+00 -3.209630E+00 -3.212321E+00 -3.211750E+00 -3.212453E+00 -3.213370E+00 -3.211791E+00 -3.212685E+00 +3.214145E+00 +3.225292E+00 +3.229509E+00 +3.228530E+00 +3.224203E+00 +3.225547E+00 +3.224720E+00 +3.224546E+00 +3.224527E+00 +3.223579E+00 +3.224380E+00 +3.223483E+00 +3.222819E+00 +3.223067E+00 +3.224007E+00 +3.220616E+00 cmfd balance 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -6.348026E-03 -5.102747E-03 -4.043947E-03 -3.952742E-03 -2.533934E-03 -2.215030E-03 -2.945032E-03 -2.597862E-03 -2.300873E-03 -1.991974E-03 -1.679430E-03 -1.636923E-03 -1.581336E-03 -1.431472E-03 -1.419168E-03 -1.256242E-03 +4.801684E-03 +2.802571E-03 +1.828029E-03 +2.220542E-03 +1.709900E-03 +2.008246E-03 +2.578373E-03 +2.000076E-03 +1.645365E-03 +1.462882E-03 +1.208273E-03 +1.146126E-03 +1.214196E-03 +1.082376E-03 +8.967163E-04 +1.154433E-03 cmfd dominance ratio 0.000E+00 0.000E+00 0.000E+00 0.000E+00 - 5.524E-01 - 5.476E-01 + 5.472E-01 + 5.521E-01 + 5.445E-01 + 5.527E-01 + 5.488E-01 + 5.078E-01 5.474E-01 - 5.419E-01 - 5.443E-01 - 5.448E-01 - 5.408E-01 - 5.391E-01 - 5.400E-01 - 5.396E-01 - 5.408E-01 - 5.398E-01 - 5.398E-01 - 5.399E-01 - 5.388E-01 - 5.389E-01 + 5.475E-01 + 5.473E-01 + 5.469E-01 + 5.461E-01 + 5.455E-01 + 5.454E-01 + 5.459E-01 + 5.460E-01 + 5.432E-01 cmfd openmc source comparison 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -8.388554E-03 -7.868057E-03 -6.387209E-03 -6.979018E-03 -5.634468E-03 -5.579466E-03 -5.647779E-03 -5.289856E-03 -4.550547E-03 -4.373716E-03 -4.042350E-03 -3.813510E-03 -3.749151E-03 -3.358126E-03 -3.562360E-03 -3.904942E-03 +9.186654E-03 +6.033650E-03 +3.920380E-03 +4.218939E-03 +4.591972E-03 +4.042772E-03 +4.100500E-03 +3.664495E-03 +3.266803E-03 +3.164213E-03 +3.310474E-03 +3.165822E-03 +3.849586E-03 +2.718170E-03 +2.431480E-03 +3.322902E-03 cmfd source -4.142294E-02 -7.484382E-02 -1.050784E-01 -1.256771E-01 -1.444717E-01 -1.420230E-01 -1.350735E-01 -1.118744E-01 -7.755343E-02 -4.198177E-02 +4.296288E-02 +7.964357E-02 +1.107722E-01 +1.359821E-01 +1.425321E-01 +1.356719E-01 +1.285829E-01 +1.040603E-01 +7.630230E-02 +4.348975E-02 diff --git a/tests/test_cmfd_nofeed/results_true.dat b/tests/test_cmfd_nofeed/results_true.dat index da9b802e7..e70287bf7 100644 --- a/tests/test_cmfd_nofeed/results_true.dat +++ b/tests/test_cmfd_nofeed/results_true.dat @@ -1,128 +1,128 @@ k-combined: -1.170519E+00 8.422960E-03 +1.171115E+00 6.173328E-03 tally 1: -1.078122E+01 -1.170828E+01 -1.999878E+01 -4.018561E+01 -2.812898E+01 -7.936860E+01 -3.362276E+01 -1.133841E+02 -3.714459E+01 -1.382628E+02 -3.828125E+01 -1.470408E+02 -3.599263E+01 -1.299451E+02 -3.090749E+01 -9.596105E+01 -2.144103E+01 -4.630323E+01 -1.143002E+01 -1.314355E+01 +1.151618E+01 +1.331859E+01 +2.120660E+01 +4.514836E+01 +2.759616E+01 +7.639131E+01 +3.216668E+01 +1.036501E+02 +3.664720E+01 +1.345450E+02 +3.771246E+01 +1.424209E+02 +3.523750E+01 +1.245225E+02 +2.973298E+01 +8.860064E+01 +2.152108E+01 +4.647187E+01 +1.169538E+01 +1.375047E+01 tally 2: -2.247115E+01 -2.548076E+01 -1.574700E+01 -1.251937E+01 -2.119907E+00 -2.284737E-01 -4.160187E+01 -8.733627E+01 -2.945600E+01 -4.383448E+01 -4.027136E+00 -8.279807E-01 -5.722117E+01 -1.643758E+02 -4.057100E+01 -8.267151E+01 -5.388803E+00 -1.465180E+00 -6.769175E+01 -2.300722E+02 -4.800300E+01 -1.157663E+02 -6.213554E+00 -1.946061E+00 -7.376629E+01 -2.729166E+02 -5.253400E+01 -1.385018E+02 -6.438590E+00 -2.103693E+00 -7.454128E+01 -2.790080E+02 -5.311800E+01 -1.417584E+02 -6.784745E+00 -2.328936E+00 -6.907125E+01 -2.397912E+02 -4.912000E+01 -1.213330E+02 -6.405754E+00 -2.075535E+00 -6.012056E+01 -1.815248E+02 -4.280600E+01 -9.207864E+01 -5.534450E+00 -1.555396E+00 -4.229808E+01 -8.999380E+01 -3.003200E+01 -4.541718E+01 -3.844618E+00 -7.537006E-01 -2.272774E+01 -2.597695E+01 -1.577800E+01 -1.252728E+01 -2.221451E+00 -2.528223E-01 +2.274639E+01 +2.606952E+01 +1.588200E+01 +1.270445E+01 +2.140989E+00 +2.357207E-01 +4.205792E+01 +8.880940E+01 +2.970000E+01 +4.427086E+01 +3.919645E+00 +7.773724E-01 +5.560960E+01 +1.559764E+02 +3.947900E+01 +7.872700E+01 +5.238942E+00 +1.400918E+00 +6.492259E+01 +2.117369E+02 +4.612200E+01 +1.069035E+02 +5.989449E+00 +1.813201E+00 +7.217377E+01 +2.608499E+02 +5.148500E+01 +1.327923E+02 +6.607336E+00 +2.205529E+00 +7.305896E+01 +2.681514E+02 +5.187500E+01 +1.352457E+02 +6.722921E+00 +2.290262E+00 +6.884269E+01 +2.380550E+02 +4.904800E+01 +1.208314E+02 +6.177320E+00 +1.927173E+00 +5.902100E+01 +1.748370E+02 +4.201000E+01 +8.858460E+01 +5.542381E+00 +1.549108E+00 +4.268091E+01 +9.151405E+01 +3.029500E+01 +4.614050E+01 +3.822093E+00 +7.420139E-01 +2.362279E+01 +2.812041E+01 +1.653100E+01 +1.377737E+01 +2.336090E+00 +2.851840E-01 tally 3: -1.517200E+01 -1.162361E+01 -9.172562E-01 -4.342120E-02 -2.835000E+01 -4.061736E+01 -1.868192E+00 -1.761390E-01 -3.911800E+01 -7.686442E+01 -2.478956E+00 -3.088180E-01 -4.617600E+01 -1.071239E+02 -2.980518E+00 -4.488545E-01 -5.059100E+01 -1.284662E+02 -3.257651E+00 -5.341674E-01 -5.115000E+01 -1.314866E+02 -3.365441E+00 -5.729274E-01 -4.732100E+01 -1.126317E+02 -3.051596E+00 -4.705140E-01 -4.120700E+01 -8.535705E+01 -2.704451E+00 -3.705800E-01 -2.900900E+01 -4.238065E+01 -1.872660E+00 -1.780668E-01 -1.520000E+01 -1.162785E+01 -1.007084E+00 -5.171907E-02 +1.523800E+01 +1.170551E+01 +1.071050E+00 +5.839198E-02 +2.862100E+01 +4.111143E+01 +1.892774E+00 +1.812712E-01 +3.804200E+01 +7.314552E+01 +2.423654E+00 +2.968521E-01 +4.433500E+01 +9.878201E+01 +2.823929E+00 +4.033633E-01 +4.954300E+01 +1.229796E+02 +3.226029E+00 +5.265680E-01 +4.999000E+01 +1.256279E+02 +3.232464E+00 +5.286388E-01 +4.723500E+01 +1.120638E+02 +3.015553E+00 +4.606928E-01 +4.050800E+01 +8.237529E+01 +2.592073E+00 +3.412174E-01 +2.911800E+01 +4.263022E+01 +1.875109E+00 +1.785438E-01 +1.592800E+01 +1.279461E+01 +1.038638E+00 +5.538157E-02 tally 4: 0.000000E+00 0.000000E+00 @@ -160,8 +160,8 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -3.017000E+00 -4.575810E-01 +3.065000E+00 +4.742170E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -208,10 +208,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -5.447000E+00 -1.491865E+00 -2.697000E+00 -3.709330E-01 +5.420000E+00 +1.474674E+00 +2.693000E+00 +3.667090E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -256,10 +256,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -7.403000E+00 -2.751813E+00 -5.151000E+00 -1.334701E+00 +7.243000E+00 +2.637431E+00 +5.092000E+00 +1.305200E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -304,10 +304,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -8.635000E+00 -3.741143E+00 -7.048000E+00 -2.495310E+00 +8.280000E+00 +3.445670E+00 +6.765000E+00 +2.307253E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -352,10 +352,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -9.381000E+00 -4.415619E+00 -8.456000E+00 -3.587840E+00 +8.980000E+00 +4.046484E+00 +8.108000E+00 +3.299338E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -400,10 +400,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -9.297000E+00 -4.334551E+00 -9.198000E+00 -4.240540E+00 +9.016000E+00 +4.079320E+00 +8.962000E+00 +4.034032E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -448,10 +448,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -8.737000E+00 -3.843559E+00 -9.508000E+00 -4.553256E+00 +8.465000E+00 +3.595665E+00 +9.296000E+00 +4.340524E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -496,10 +496,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -7.338000E+00 -2.709162E+00 -8.888000E+00 -3.969398E+00 +7.247000E+00 +2.638527E+00 +8.865000E+00 +3.946315E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -544,10 +544,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -5.354000E+00 -1.442386E+00 -7.584000E+00 -2.887298E+00 +5.179000E+00 +1.353661E+00 +7.492000E+00 +2.817588E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -592,10 +592,10 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -2.707000E+00 -3.709270E-01 -5.507000E+00 -1.522587E+00 +2.821000E+00 +4.067990E-01 +5.617000E+00 +1.587757E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -642,8 +642,8 @@ tally 4: 0.000000E+00 0.000000E+00 0.000000E+00 -3.112000E+00 -4.868600E-01 +3.134000E+00 +4.937920E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -662,114 +662,114 @@ k cmfd 0.000000E+00 0.000000E+00 0.000000E+00 -1.150583E+00 -1.160876E+00 -1.160893E+00 -1.157393E+00 -1.157826E+00 -1.163206E+00 -1.169286E+00 -1.169322E+00 -1.169866E+00 -1.177576E+00 -1.183172E+00 -1.184784E+00 -1.186581E+00 -1.183233E+00 -1.181032E+00 -1.180107E+00 +1.177990E+00 +1.160491E+00 +1.145875E+00 +1.148719E+00 +1.140676E+00 +1.141509E+00 +1.143597E+00 +1.141954E+00 +1.150311E+00 +1.155088E+00 +1.155464E+00 +1.152786E+00 +1.156950E+00 +1.159040E+00 +1.160571E+00 +1.161251E+00 cmfd entropy 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -3.215201E+00 -3.214833E+00 -3.211409E+00 -3.218241E+00 -3.220068E+00 -3.217667E+00 -3.214425E+00 -3.215427E+00 -3.214339E+00 -3.212343E+00 -3.211075E+00 -3.211281E+00 -3.209704E+00 -3.210597E+00 -3.213481E+00 -3.213943E+00 +3.214145E+00 +3.222082E+00 +3.225870E+00 +3.230292E+00 +3.228784E+00 +3.228863E+00 +3.228331E+00 +3.230222E+00 +3.231212E+00 +3.230979E+00 +3.229831E+00 +3.229258E+00 +3.228559E+00 +3.227915E+00 +3.227427E+00 +3.229561E+00 cmfd balance 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -6.348026E-03 -4.651411E-03 -3.551519E-03 -2.893286E-03 -2.930836E-03 -2.342081E-03 -2.443793E-03 -2.380658E-03 -2.091259E-03 -2.144887E-03 -2.055334E-03 -1.907704E-03 -1.879350E-03 -1.598308E-03 -1.247988E-03 -1.179680E-03 +4.801684E-03 +3.228380E-03 +2.568997E-03 +2.195796E-03 +2.248884E-03 +3.405416E-03 +2.332198E-03 +2.576061E-03 +2.326651E-03 +2.324425E-03 +2.205364E-03 +2.112702E-03 +1.864656E-03 +1.804877E-03 +1.557106E-03 +1.312058E-03 cmfd dominance ratio 0.000E+00 0.000E+00 0.000E+00 0.000E+00 - 5.524E-01 - 5.492E-01 - 5.459E-01 - 5.486E-01 - 5.475E-01 - 5.455E-01 - 5.433E-01 - 5.425E-01 - 5.412E-01 - 5.404E-01 - 5.399E-01 - 5.400E-01 - 5.401E-01 - 5.414E-01 - 5.433E-01 - 5.437E-01 + 5.472E-01 + 5.510E-01 + 5.519E-01 + 5.535E-01 + 5.535E-01 + 5.505E-01 + 5.488E-01 + 5.505E-01 + 5.510E-01 + 5.513E-01 + 5.510E-01 + 5.508E-01 + 5.487E-01 + 5.489E-01 + 5.481E-01 + 5.499E-01 cmfd openmc source comparison 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -8.388554E-03 -6.525044E-03 -5.810856E-03 -3.651620E-03 -3.448625E-03 -3.805838E-03 -4.064235E-03 -3.244723E-03 -3.963513E-03 -4.186768E-03 -3.785555E-03 -2.732731E-03 -2.308430E-03 -2.074797E-03 -1.581512E-03 -1.729988E-03 +9.186654E-03 +5.964812E-03 +4.465905E-03 +4.119425E-03 +4.973577E-03 +4.092492E-03 +4.063342E-03 +2.804589E-03 +3.632667E-03 +5.005042E-03 +3.428575E-03 +3.007070E-03 +3.091465E-03 +3.030625E-03 +2.751739E-03 +1.762364E-03 cmfd source -3.816410E-02 -7.860013E-02 -1.050204E-01 -1.270331E-01 -1.389768E-01 -1.438216E-01 -1.304530E-01 -1.155470E-01 -7.975741E-02 -4.262650E-02 +4.538792E-02 +8.103354E-02 +1.045198E-01 +1.221411E-01 +1.398214E-01 +1.401011E-01 +1.305055E-01 +1.120110E-01 +8.032924E-02 +4.414939E-02 diff --git a/tests/test_density_atombcm/results_true.dat b/tests/test_density_atombcm/results_true.dat index 384fb593e..2956b5388 100644 --- a/tests/test_density_atombcm/results_true.dat +++ b/tests/test_density_atombcm/results_true.dat @@ -1,2 +1,2 @@ k-combined: -1.760126E+00 1.038820E-02 +1.752274E+00 4.032481E-02 diff --git a/tests/test_density_atomcm3/results_true.dat b/tests/test_density_atomcm3/results_true.dat index 3feb35ba1..0bd16fc4d 100644 --- a/tests/test_density_atomcm3/results_true.dat +++ b/tests/test_density_atomcm3/results_true.dat @@ -1,2 +1,2 @@ k-combined: -1.092203E+00 1.990176E-02 +1.092376E+00 1.759788E-02 diff --git a/tests/test_density_kgm3/results_true.dat b/tests/test_density_kgm3/results_true.dat index c5942e1a2..6b008101f 100644 --- a/tests/test_density_kgm3/results_true.dat +++ b/tests/test_density_kgm3/results_true.dat @@ -1,2 +1,2 @@ k-combined: -8.085745E-01 9.674599E-03 +7.994522E-01 1.065745E-02 diff --git a/tests/test_density_sum/results_true.dat b/tests/test_density_sum/results_true.dat index 418331925..9b16f2d98 100644 --- a/tests/test_density_sum/results_true.dat +++ b/tests/test_density_sum/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.319139E-01 1.688777E-02 +3.231215E-01 6.421320E-03 diff --git a/tests/test_eigenvalue_genperbatch/results_true.dat b/tests/test_eigenvalue_genperbatch/results_true.dat index d6aac0453..9e87c901d 100644 --- a/tests/test_eigenvalue_genperbatch/results_true.dat +++ b/tests/test_eigenvalue_genperbatch/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.012381E-01 1.890480E-03 +3.015627E-01 5.978844E-03 diff --git a/tests/test_eigenvalue_no_inactive/results_true.dat b/tests/test_eigenvalue_no_inactive/results_true.dat index d7575db1f..fbbe84cc3 100644 --- a/tests/test_eigenvalue_no_inactive/results_true.dat +++ b/tests/test_eigenvalue_no_inactive/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.066374E-01 7.794575E-03 +3.130246E-01 6.960311E-03 diff --git a/tests/test_energy_grid/results_true.dat b/tests/test_energy_grid/results_true.dat index 05cda2e98..9556a981b 100644 --- a/tests/test_energy_grid/results_true.dat +++ b/tests/test_energy_grid/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.215828E-01 2.966835E-03 +3.155788E-01 7.559348E-03 diff --git a/tests/test_entropy/results_true.dat b/tests/test_entropy/results_true.dat index a3515ba2b..8b37789c3 100644 --- a/tests/test_entropy/results_true.dat +++ b/tests/test_entropy/results_true.dat @@ -1,13 +1,13 @@ k-combined: -3.011726E-01 1.841644E-03 +3.021779E-01 3.813358E-03 entropy: 7.608094E+00 8.167702E+00 8.273634E+00 -8.238974E+00 -8.307173E+00 -8.239618E+00 -8.230443E+00 -8.201657E+00 -8.289158E+00 -8.364683E+00 +8.239452E+00 +8.234598E+00 +8.278421E+00 +8.260773E+00 +8.351860E+00 +8.303719E+00 +8.271058E+00 diff --git a/tests/test_filter_cell/results_true.dat b/tests/test_filter_cell/results_true.dat index 0838e7bae..f3aa5d89b 100644 --- a/tests/test_filter_cell/results_true.dat +++ b/tests/test_filter_cell/results_true.dat @@ -1,11 +1,11 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: 0.000000E+00 0.000000E+00 -1.517577E+01 -4.747271E+01 -3.151504E+00 -2.051857E+00 -4.536316E+01 -4.258781E+02 +1.423676E+01 +4.330937E+01 +2.914798E+00 +1.831649E+00 +4.088282E+01 +3.662539E+02 diff --git a/tests/test_filter_cellborn/results_true.dat b/tests/test_filter_cellborn/results_true.dat index d2fa7f700..36dcf40d0 100644 --- a/tests/test_filter_cellborn/results_true.dat +++ b/tests/test_filter_cellborn/results_true.dat @@ -1,10 +1,10 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: 0.000000E+00 0.000000E+00 -7.449502E+01 -1.145793E+03 +7.007584E+01 +1.050827E+03 0.000000E+00 0.000000E+00 0.000000E+00 diff --git a/tests/test_filter_energy/results_true.dat b/tests/test_filter_energy/results_true.dat index 9e3ab7965..e3f6cff98 100644 --- a/tests/test_filter_energy/results_true.dat +++ b/tests/test_filter_energy/results_true.dat @@ -1,11 +1,11 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -2.687671E+01 -1.475192E+02 -4.148025E+01 -3.443331E+02 -5.223662E+01 -5.466362E+02 -1.050254E+01 -2.218108E+01 +2.770022E+01 +1.559167E+02 +4.285040E+01 +3.679177E+02 +5.288354E+01 +5.619308E+02 +1.134904E+01 +2.579927E+01 diff --git a/tests/test_filter_energyout/results_true.dat b/tests/test_filter_energyout/results_true.dat index fa0bfa646..649f4d725 100644 --- a/tests/test_filter_energyout/results_true.dat +++ b/tests/test_filter_energyout/results_true.dat @@ -1,11 +1,11 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -2.740000E+01 -1.516786E+02 -4.163000E+01 -3.469463E+02 -5.041000E+01 -5.097599E+02 -6.990000E+00 -9.850700E+00 +2.835000E+01 +1.631463E+02 +4.252000E+01 +3.622146E+02 +5.192000E+01 +5.401444E+02 +7.390000E+00 +1.097710E+01 diff --git a/tests/test_filter_group_transfer/results_true.dat b/tests/test_filter_group_transfer/results_true.dat index 222255827..f2d5faa99 100644 --- a/tests/test_filter_group_transfer/results_true.dat +++ b/tests/test_filter_group_transfer/results_true.dat @@ -1,54 +1,54 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -2.470000E+01 -1.233286E+02 +2.571000E+01 +1.344145E+02 0.000000E+00 0.000000E+00 -7.000000E-02 -2.100000E-03 +2.000000E-02 +2.000000E-04 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -8.590851E-01 -1.552999E-01 +8.909862E-01 +1.660072E-01 0.000000E+00 0.000000E+00 -2.474615E+00 -1.227479E+00 -2.700000E+00 -1.469800E+00 +2.269580E+00 +1.046926E+00 +2.640000E+00 +1.397800E+00 0.000000E+00 0.000000E+00 -3.712000E+01 -2.758636E+02 +3.799000E+01 +2.892451E+02 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -3.370712E-01 -2.596756E-02 +3.267964E-01 +2.170374E-02 0.000000E+00 0.000000E+00 -9.771334E-01 -1.963983E-01 +8.811378E-01 +1.642094E-01 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -4.440000E+00 -3.947400E+00 +4.510000E+00 +4.068900E+00 0.000000E+00 0.000000E+00 -4.688000E+01 -4.409726E+02 -2.867366E-02 -2.783031E-04 +4.842000E+01 +4.700146E+02 +6.079426E-02 +8.532151E-04 0.000000E+00 0.000000E+00 -1.080794E-01 -2.580055E-03 +1.182446E-01 +3.979568E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -57,11 +57,11 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -3.530000E+00 -2.494900E+00 -1.572766E-01 -5.137814E-03 -6.990000E+00 -9.850700E+00 -3.134136E-01 -2.138680E-02 +3.500000E+00 +2.455800E+00 +1.158638E-01 +2.993934E-03 +7.390000E+00 +1.097710E+01 +3.126942E-01 +2.185793E-02 diff --git a/tests/test_filter_material/results_true.dat b/tests/test_filter_material/results_true.dat index 3d15ea432..86e1e943c 100644 --- a/tests/test_filter_material/results_true.dat +++ b/tests/test_filter_material/results_true.dat @@ -1,11 +1,11 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -2.819256E+01 -1.591068E+02 -6.599750E+00 -8.721650E+00 -5.383171E+01 -5.950793E+02 -4.140672E+01 -3.649396E+02 +2.923791E+01 +1.711686E+02 +6.753642E+00 +9.145065E+00 +4.921142E+01 +5.186991E+02 +4.731999E+01 +4.905260E+02 diff --git a/tests/test_filter_mesh_2d/results_true.dat b/tests/test_filter_mesh_2d/results_true.dat index 01aea5afe..21946086b 100644 --- a/tests/test_filter_mesh_2d/results_true.dat +++ b/tests/test_filter_mesh_2d/results_true.dat @@ -1,5 +1,5 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: 0.000000E+00 0.000000E+00 @@ -45,8 +45,10 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -8.751430E-01 -7.658753E-01 +3.228098E-02 +1.042062E-03 +3.222708E-01 +1.038585E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -73,14 +75,26 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +8.182335E-01 +3.748630E-01 +2.711997E-01 +5.338821E-02 +3.359680E-01 +5.168399E-02 0.000000E+00 0.000000E+00 -1.287286E-01 -1.657106E-02 -7.512292E-01 -1.499955E-01 -2.231206E+00 -1.531548E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +3.706070E-01 +1.373496E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -95,120 +109,106 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -0.000000E+00 -0.000000E+00 -6.855163E-02 -4.699326E-03 -6.967594E-02 -4.854737E-03 -0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -9.993440E-02 -9.986884E-03 -1.978123E-01 -3.912972E-02 -8.758664E-02 -7.671419E-03 -4.204632E-01 -7.722514E-02 -2.486465E+00 -1.923132E+00 -1.697091E-01 -1.631523E-02 -0.000000E+00 -0.000000E+00 +3.931419E-01 +9.002841E-02 +1.092722E+00 +3.733055E-01 +2.384227E+00 +1.926937E+00 +9.101131E-01 +3.634496E-01 +3.284661E-01 +1.078900E-01 0.000000E+00 0.000000E+00 6.885295E-02 4.740728E-03 0.000000E+00 0.000000E+00 -6.175782E-01 -2.022672E-01 -1.204200E-02 -8.137904E-05 -2.136417E-01 -1.678274E-02 -2.932366E-01 -4.285227E-02 -6.387464E-01 -1.526040E-01 +2.419633E-02 +5.854622E-04 +9.286912E-02 +7.247209E-03 +5.629729E-01 +9.281109E-02 +7.345786E-01 +1.755550E-01 +1.219449E-01 +1.487057E-02 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -1.062751E+00 -3.899247E-01 -1.264401E+00 -5.654864E-01 -1.615537E+00 -5.605431E-01 -4.267750E-01 -1.013728E-01 -2.024264E+00 -9.373843E-01 -1.122195E-01 -7.011342E-03 -8.223839E-01 -2.170405E-01 -1.239203E+00 -4.165595E-01 -1.169828E+00 -4.406334E-01 -1.373464E+00 -6.398480E-01 -2.824398E+00 -2.991665E+00 -6.158518E-01 -1.951901E-01 -7.188149E-01 -1.091668E-01 -7.595527E-01 -2.108412E-01 -5.784902E-01 -1.362812E-01 -7.167515E-01 -3.225769E-01 -2.081496E-02 -4.332627E-04 -9.212853E-01 -2.277306E-01 -1.266470E+00 -6.777774E-01 +1.983303E-01 +3.797884E-02 +4.840974E-02 +1.266547E-03 +1.183485E+00 +4.184814E-01 +3.027254E-01 +8.598449E-02 +9.889868E-01 +4.608531E-01 +8.698103E-01 +4.598559E-01 +1.332831E+00 +4.809984E-01 +1.564949E+00 +5.782651E-01 +1.143572E+00 +4.399439E-01 +1.326651E+00 +6.376565E-01 +1.716813E+00 +1.314280E+00 +7.673229E-01 +2.364966E-01 +2.539284E+00 +1.945563E+00 +1.263219E+00 +4.919339E-01 +5.430042E-01 +1.300266E-01 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +7.553587E-01 +1.738170E-01 +2.048487E+00 +1.239856E+00 3.761862E-01 8.452912E-02 -1.350273E-02 -1.823238E-04 -3.348203E-01 -6.603737E-02 -2.382593E-01 -2.884302E-02 -1.548117E+00 -7.256982E-01 -9.635803E-01 -4.452538E-01 -1.030188E+00 -3.496685E-01 -7.053043E-01 -2.814424E-01 -1.260458E-01 -8.365754E-03 -1.484515E+00 -7.183840E-01 -1.887042E+00 -1.143800E+00 -3.798783E+00 -4.487065E+00 -2.274180E+00 -1.991784E+00 -1.903719E-01 -3.237886E-02 -0.000000E+00 -0.000000E+00 0.000000E+00 0.000000E+00 +9.675232E-02 +9.361012E-03 +2.319594E-01 +2.331698E-02 +1.573495E+00 +6.394722E-01 +4.432570E-01 +1.005943E-01 +9.353148E-01 +3.125416E-01 +8.359366E-01 +2.985072E-01 +1.657665E+00 +9.207020E-01 +3.737550E+00 +3.558505E+00 +1.742376E+00 +8.732217E-01 +5.153816E+00 +6.543973E+00 +1.653035E+00 +1.061068E+00 +9.963191E-01 +3.716347E-01 +2.282805E-01 +2.383414E-02 +8.749983E-01 +2.714666E-01 1.728411E-01 1.190218E-02 9.250054E-02 @@ -219,28 +219,28 @@ tally 1: 1.711154E-02 3.218800E-01 7.906855E-02 -9.721141E-01 -3.463278E-01 -8.364857E-01 -2.612988E-01 -6.317454E-01 -1.837078E-01 -2.134394E-01 -1.710045E-02 -3.743814E-02 -1.401614E-03 -1.314651E+00 -7.700853E-01 -7.389940E-01 -2.322340E-01 -6.147456E-01 -1.001719E-01 -3.157573E+00 -2.794673E+00 -6.671644E-01 -1.996570E-01 -0.000000E+00 -0.000000E+00 +1.057036E+00 +3.778638E-01 +9.231639E-01 +2.991795E-01 +3.375678E-01 +1.041383E-01 +1.181686E-01 +8.023920E-03 +4.912969E-01 +2.073894E-01 +9.395786E-01 +4.653730E-01 +6.998437E-01 +2.917085E-01 +3.074214E+00 +2.819088E+00 +2.570673E+00 +1.358321E+00 +1.108912E+00 +3.843307E-01 +4.950896E-02 +2.451137E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -255,24 +255,24 @@ tally 1: 7.670183E-03 0.000000E+00 0.000000E+00 -9.451595E-01 -2.560533E-01 -2.255990E+00 -1.237092E+00 -9.318430E-01 -2.664794E-01 -5.320317E-01 -2.267827E-01 -9.971891E-01 -5.070904E-01 -7.088786E-02 -5.025089E-03 -3.601108E-02 -1.296798E-03 -3.683352E+00 -3.243246E+00 -3.708141E+00 -3.629996E+00 +6.469411E-01 +1.789549E-01 +7.829878E-01 +2.033989E-01 +8.994770E-01 +2.351438E-01 +4.712797E-01 +7.213659E-02 +2.133532E+00 +9.765422E-01 +4.533607E-01 +1.511497E-01 +1.878729E+00 +2.099266E+00 +4.287190E+00 +4.748691E+00 +1.961229E+00 +1.085868E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -285,28 +285,28 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -1.238471E-01 -1.533812E-02 -2.580606E+00 -1.878196E+00 -2.843921E+00 -1.997749E+00 -1.145124E+00 -4.571704E-01 -1.135664E+00 -4.319756E-01 +1.061692E-01 +1.127190E-02 +1.912282E-01 +3.656822E-02 +3.289827E-01 +1.075283E-01 +1.750908E+00 +8.092384E-01 +2.156426E+00 +9.498067E-01 +1.480596E+00 +6.002164E-01 +3.249216E-01 +1.005106E-01 8.875810E-02 7.878000E-03 -7.494206E-02 -5.616313E-03 -1.007353E+00 -3.619658E-01 -1.649444E+00 -7.918743E-01 +2.458176E-01 +4.377921E-02 +2.766784E+00 +2.677426E+00 +2.703501E+00 +2.548083E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -319,28 +319,28 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -6.286351E-01 -1.805028E-01 -1.595058E+00 -6.351621E-01 -1.568755E+00 -6.468874E-01 -2.301331E+00 -1.845232E+00 -4.577930E-01 -1.589685E-01 +1.981880E-01 +3.927848E-02 +2.789456E-01 +5.304261E-02 +3.897689E-01 +9.413685E-02 +9.140885E-01 +2.822974E-01 +1.887726E+00 +7.592780E-01 +1.841624E+00 +1.680236E+00 +4.059938E-01 +1.562853E-01 2.897077E-01 8.393057E-02 0.000000E+00 0.000000E+00 -0.000000E+00 -0.000000E+00 -1.772980E-01 -3.143459E-02 +2.445051E-01 +5.978276E-02 +2.234657E-01 +2.716625E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -353,24 +353,24 @@ tally 1: 0.000000E+00 4.783335E-02 2.288029E-03 -8.744336E-01 -2.611835E-01 -1.754522E+00 -1.459573E+00 -3.549403E-01 -6.365363E-02 -1.843261E+00 -9.517219E-01 -1.009556E+00 -4.611770E-01 -1.540221E+00 -7.611324E-01 -8.030427E-01 -2.255596E-01 +5.606011E-01 +1.607491E-01 +1.908325E+00 +1.505641E+00 +1.255795E-01 +1.541635E-02 +7.395548E-01 +2.274416E-01 +5.986733E-01 +9.576988E-02 +1.095026E+00 +4.872910E-01 +1.043470E+00 +3.153965E-01 1.004973E+00 6.046910E-01 -1.664911E-01 -2.771927E-02 +1.724071E-01 +2.775427E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -385,114 +385,114 @@ tally 1: 0.000000E+00 5.470039E-01 2.992133E-01 -4.902613E-01 -1.163360E-01 +4.313918E-01 +1.128703E-01 1.088037E+00 6.007745E-01 1.013469E+00 5.646900E-01 -5.529904E-01 -2.308161E-01 -3.523818E-01 -1.241729E-01 -2.031343E-01 -4.126355E-02 -2.664927E+00 -2.323850E+00 -2.601166E+00 -1.593528E+00 -1.726764E+00 -6.491827E-01 -7.083106E-02 -3.090181E-03 +4.738741E-01 +2.245567E-01 +6.086518E-02 +3.704570E-03 +1.126662E+00 +4.675322E-01 +1.008459E+00 +4.616352E-01 +1.309592E+00 +5.665211E-01 +1.334050E+00 +5.264819E-01 +7.324996E-01 +2.577124E-01 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 +3.227736E-01 +1.041828E-01 +9.218244E-01 +2.000301E-01 +2.119900E+00 +1.123846E+00 +4.366404E-02 +1.015133E-03 0.000000E+00 0.000000E+00 -2.213571E-01 -2.455759E-02 -1.471329E+00 -7.001977E-01 -6.348345E-01 -1.603344E-01 -0.000000E+00 -0.000000E+00 -7.240936E-01 -1.701659E-01 -1.280272E+00 -3.624213E-01 -9.794833E-01 -4.411714E-01 +2.309730E-01 +2.570742E-02 +1.270911E+00 +4.617932E-01 +1.107069E+00 +4.574496E-01 1.269137E-01 1.610709E-02 -1.120245E-01 -1.254949E-02 +2.207099E-01 +4.871286E-02 +9.075694E-02 +8.236821E-03 +1.046380E-01 +7.875036E-03 +2.836364E-01 +3.508209E-02 +4.509177E-01 +7.393615E-02 +1.077505E+00 +3.209541E-01 +1.204982E-02 +1.451982E-04 0.000000E+00 0.000000E+00 -8.072240E-01 -2.272369E-01 -3.032594E-01 -5.076695E-02 -7.265258E-01 -1.893670E-01 -2.902123E-01 -3.514713E-02 +0.000000E+00 +0.000000E+00 +2.502937E-01 +5.035125E-02 +1.367234E+00 +5.128884E-01 +5.563575E-01 +2.510519E-01 +3.174809E-01 +1.007941E-01 +9.152129E-01 +2.609325E-01 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0.000000E+00 0.000000E+00 @@ -753,12 +753,10 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +3.228098E-02 +1.042062E-03 0.000000E+00 0.000000E+00 -4.083602E-01 -1.667580E-01 -4.667828E-01 -2.178862E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -789,6 +787,8 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +3.222708E-01 +1.038585E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1261,14 +1261,18 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +2.009463E-01 +4.037943E-02 +1.741795E-01 +3.033850E-02 +4.431077E-01 +1.023945E-01 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -1.287286E-01 -1.657106E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1295,14 +1299,10 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -2.269274E-02 -5.149605E-04 -9.624622E-02 -9.263335E-03 -1.387020E-01 -1.620196E-02 -4.935882E-01 -8.865346E-02 +1.699856E-01 +1.749182E-02 +1.012141E-01 +1.024430E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1329,14 +1329,12 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -1.467757E+00 -6.282919E-01 -3.159457E-01 -4.516223E-02 -2.050369E-01 -3.908542E-02 -2.424662E-01 -5.878987E-02 +2.427282E-01 +4.346756E-02 +8.576175E-02 +6.594648E-03 +7.478060E-03 +5.592138E-05 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1581,6 +1579,10 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +6.645869E-02 +4.416757E-03 +3.041483E-01 +9.250621E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1655,8 +1657,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -6.855163E-02 -4.699326E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1687,10 +1687,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -4.206687E-02 -1.769622E-03 -2.760907E-02 -7.622607E-04 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1777,8 +1773,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -9.993440E-02 -9.986884E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1809,10 +1803,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -8.032141E-03 -6.451529E-05 -1.897802E-01 -3.601652E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1843,8 +1833,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -8.758664E-02 -7.671419E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1855,6 +1843,8 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +3.931419E-01 +9.002841E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1875,12 +1865,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -6.797399E-03 -4.620463E-05 -1.681205E-01 -1.033597E-02 -2.455452E-01 -4.194938E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1891,6 +1875,12 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +1.775906E-01 +3.153842E-02 +8.691809E-01 +2.255229E-01 +4.595089E-02 +2.111485E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -1907,12 +1897,22 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -1.983445E-01 -1.408489E-02 -3.095279E-01 -4.471018E-02 -1.669298E+00 -8.584140E-01 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 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0.000000E+00 -6.311586E-01 -1.452469E-01 -8.935124E-01 -2.041594E-01 -9.086642E-02 -7.846733E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -2453,8 +2455,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -1.240497E-01 -1.538832E-02 9.205825E-02 8.474722E-03 2.106671E-01 @@ -2487,12 +2487,12 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -6.706461E-01 -1.626955E-01 -9.690652E-01 -2.037373E-01 -1.260082E-01 -1.587806E-02 +2.518202E-01 +6.341342E-02 +3.500938E-01 +5.019217E-02 +1.285282E-01 +1.588441E-02 2.585446E-01 6.684532E-02 0.000000E+00 @@ -2523,8 +2523,10 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -1.960309E-02 -3.842813E-04 +3.653135E-01 +1.287514E-01 +2.216045E-03 +4.910856E-06 0.000000E+00 0.000000E+00 0.000000E+00 @@ -2543,10 +2545,8 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -0.000000E+00 -0.000000E+00 -9.261638E-02 -4.454613E-03 +5.022807E-01 +1.147015E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -2577,12 +2577,12 @@ tally 1: 0.000000E+00 0.000000E+00 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-2.060666E-01 -4.246344E-02 -9.954401E-04 -9.909010E-07 -7.940105E-02 -6.304526E-03 0.000000E+00 0.000000E+00 +1.690390E-01 +2.753878E-02 +1.145975E-01 +7.543314E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7379,14 +7377,14 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -2.430716E-01 -3.335909E-02 -4.349688E-01 -6.259047E-02 -4.848533E-02 -1.782050E-03 0.000000E+00 0.000000E+00 +2.712297E-01 +3.081804E-02 +1.728614E-01 +2.076746E-02 +6.826625E-03 +4.660281E-05 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7415,10 +7413,12 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -2.242016E-02 -5.026638E-04 -2.677921E-01 -2.943321E-02 +2.649622E-02 +7.020499E-04 +4.161446E-01 +8.806248E-02 +6.348647E-01 +9.989011E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7451,6 +7451,8 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +1.204982E-02 +1.451982E-04 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7551,12 +7553,10 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -8.608891E-02 -4.586038E-03 +2.282300E-01 +4.986445E-02 +2.206365E-02 +4.868048E-04 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7587,10 +7587,10 @@ tally 1: 0.000000E+00 1.875562E-01 3.517735E-02 -5.878488E-01 -1.352380E-01 -5.442859E-01 -1.595781E-01 +7.738485E-01 +2.045432E-01 +4.058292E-01 +8.243188E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7623,16 +7623,18 @@ tally 1: 0.000000E+00 4.994213E-01 2.494217E-01 +2.744213E-02 +7.530707E-04 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 +2.949405E-02 +7.018464E-04 0.000000E+00 0.000000E+00 -2.758048E-01 -6.072497E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7659,14 +7661,16 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +8.459022E-03 +7.155505E-05 +3.090219E-01 +9.549453E-02 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -2.606443E-01 -6.793546E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7681,12 +7685,12 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +7.226097E-01 +1.395661E-01 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -3.686503E-01 -6.346661E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7715,14 +7719,14 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +2.316493E-01 +1.591047E-02 +6.576990E-01 +1.877309E-01 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -1.533157E-01 -1.071208E-02 -5.401851E-01 -1.739213E-01 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7749,14 +7753,14 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +4.546941E-01 +7.107193E-02 +3.321871E-01 +6.515778E-02 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -1.221279E+00 -4.624743E-01 -3.697846E-01 -6.689364E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7787,10 +7791,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -2.040339E-01 -4.162983E-02 -3.778476E-02 -1.427688E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7861,8 +7861,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -5.946272E-02 -3.535814E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7895,8 +7893,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -3.120645E-02 -9.738427E-04 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7931,6 +7927,10 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +8.249399E-02 +4.667888E-03 +1.814462E-01 +3.292273E-02 7.515014E-02 5.647544E-03 0.000000E+00 @@ -7957,14 +7957,14 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -2.638111E-01 -6.959629E-02 +0.000000E+00 +0.000000E+00 3.109046E-01 8.622176E-02 -2.304832E-01 -3.175419E-02 -6.218789E-02 -3.867333E-03 +2.380422E-01 +3.181133E-02 +1.087532E-01 +6.035666E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -7995,8 +7995,8 @@ tally 1: 0.000000E+00 5.246408E-03 2.752480E-05 -1.779567E-01 -2.094888E-02 +3.760855E-02 +1.251291E-03 5.951856E-02 3.037461E-03 0.000000E+00 @@ -8141,6 +8141,8 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +1.395650E-01 +1.947839E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -8163,18 +8165,20 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +2.822292E-01 +4.829456E-02 +6.080756E-02 +3.418907E-03 0.000000E+00 0.000000E+00 -7.333695E-02 -4.658577E-03 -2.790184E-02 -6.568068E-04 -0.000000E+00 -0.000000E+00 -1.525932E-01 -2.328469E-02 +1.804108E-01 +2.405851E-02 5.413665E-02 2.930777E-03 +4.041026E-01 +8.374291E-02 +5.886833E-02 +3.465481E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -8197,20 +8201,16 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 +7.093664E-02 +5.032006E-03 5.703113E-02 3.252549E-03 -8.140441E-01 -2.724079E-01 -5.579561E-01 -2.869147E-01 -2.207115E-01 -4.871356E-02 +7.402747E-01 +2.678271E-01 +2.389658E-02 +5.209213E-04 +5.348373E-01 +8.455667E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -8239,10 +8239,12 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -5.039206E-01 -1.196352E-01 -3.885001E-01 -7.594576E-02 +5.453284E-01 +1.497004E-01 +1.851055E-01 +1.721223E-02 +1.038418E-01 +1.078313E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -8261,6 +8263,8 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +6.010211E-02 +3.612264E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -8293,6 +8297,8 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +6.319919E-02 +3.629541E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -8325,14 +8331,8 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -0.000000E+00 -8.137844E-02 -5.984482E-03 +1.292774E-01 +8.674372E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -8747,14 +8747,14 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -4.235904E-01 -1.794288E-01 -2.296533E-01 -2.653997E-02 -1.867564E-01 -3.487796E-02 0.000000E+00 0.000000E+00 +4.601224E-01 +1.283387E-01 +4.851011E-01 +1.238875E-01 +1.351214E-02 +1.825779E-04 0.000000E+00 0.000000E+00 0.000000E+00 @@ -8781,12 +8781,12 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -8.285152E-02 -5.700776E-03 -1.646014E+00 -6.255979E-01 -9.809995E-01 -3.058040E-01 +7.746478E-03 +6.000792E-05 +1.551243E+00 +5.797918E-01 +1.974875E-01 +1.837196E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -8817,10 +8817,12 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -2.189281E-01 -4.001687E-02 -1.431247E-02 -2.048469E-04 +2.541705E-01 +4.325743E-02 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -8851,8 +8853,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -9.579949E-02 -9.177542E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -9359,12 +9359,14 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 +1.668786E-02 +2.784846E-04 +2.256035E-01 +5.089693E-02 +0.000000E+00 +0.000000E+00 0.000000E+00 0.000000E+00 -2.836882E-01 -8.047901E-02 -5.295973E-02 -2.804733E-03 0.000000E+00 0.000000E+00 0.000000E+00 @@ -9395,8 +9397,6 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -7.405305E-01 -5.483854E-01 0.000000E+00 0.000000E+00 0.000000E+00 diff --git a/tests/test_filter_universe/results_true.dat b/tests/test_filter_universe/results_true.dat index c63da0083..856d97d59 100644 --- a/tests/test_filter_universe/results_true.dat +++ b/tests/test_filter_universe/results_true.dat @@ -1,11 +1,11 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -6.369043E+01 -8.385422E+02 -7.330762E+00 -1.137874E+01 -5.011385E+01 -5.251276E+02 -5.132453E+00 -5.801019E+00 +5.803437E+01 +7.324822E+02 +7.168085E+00 +1.101286E+01 +5.815302E+01 +7.373019E+02 +5.778029E+00 +7.558661E+00 diff --git a/tests/test_infinite_cell/results_true.dat b/tests/test_infinite_cell/results_true.dat index 45eaa4f91..0b8d92951 100644 --- a/tests/test_infinite_cell/results_true.dat +++ b/tests/test_infinite_cell/results_true.dat @@ -1,2 +1,2 @@ k-combined: -9.998895E-02 2.846817E-04 +9.788797E-02 1.378250E-03 diff --git a/tests/test_lattice_mixed/results_true.dat b/tests/test_lattice_mixed/results_true.dat index d23feb91f..7cea76ba0 100644 --- a/tests/test_lattice_mixed/results_true.dat +++ b/tests/test_lattice_mixed/results_true.dat @@ -1,2 +1,2 @@ k-combined: -9.605085E-01 8.180822E-03 +9.922449E-01 1.281824E-02 diff --git a/tests/test_lattice_multiple/results_true.dat b/tests/test_lattice_multiple/results_true.dat index f2e3d93c9..6caffdd95 100644 --- a/tests/test_lattice_multiple/results_true.dat +++ b/tests/test_lattice_multiple/results_true.dat @@ -1,2 +1,2 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 diff --git a/tests/test_many_scores/results_true.dat b/tests/test_many_scores/results_true.dat index 191122f13..ab1c43254 100644 --- a/tests/test_many_scores/results_true.dat +++ b/tests/test_many_scores/results_true.dat @@ -1,111 +1,111 @@ k-combined: 0.000000E+00 0.000000E+00 tally 1: -2.254760E+01 -1.695439E+02 -1.017400E+01 -3.450623E+01 -8.690000E+00 -2.517771E+01 -8.696000E+00 -2.521248E+01 -5.224881E-01 -9.127522E-02 -8.690000E+00 -2.517771E+01 -9.665236E-01 -3.121401E-01 -5.224881E-01 -9.127522E-02 -5.199964E-01 -9.041516E-02 -8.696000E+00 -2.521248E+01 -9.666447E-01 -3.122176E-01 -5.199964E-01 -9.041516E-02 -9.262308E+00 -2.859762E+01 -8.684000E+00 -2.514296E+01 -1.484000E+00 -7.346160E-01 -1.804688E+00 -1.089100E+00 -1.334833E+02 -5.960573E+03 -2.254760E+01 -1.695439E+02 --6.230152E-02 -1.023784E-02 --2.696818E-01 -8.525477E-02 --1.670294E-01 -4.366614E-02 -1.331953E-02 -8.064039E-05 --2.490295E-01 -2.511425E-02 -8.289978E-02 -2.753446E-03 --1.390686E-01 -1.592673E-02 -1.600203E-01 -1.344513E-02 -1.017400E+01 -3.450623E+01 --6.564301E-02 -2.564587E-03 --1.245391E-01 -1.143479E-02 --5.550309E-02 -9.334547E-03 -4.671277E-02 -1.795787E-03 --9.901000E-02 -4.609654E-03 -2.619012E-02 -3.011793E-04 --7.090362E-02 -2.450750E-03 -4.059073E-02 -8.841300E-04 -8.690000E+00 -2.517771E+01 --2.685052E-02 -2.769798E-04 -4.047919E-03 -3.384947E-03 --1.325869E-01 -8.610169E-03 --1.594962E-02 -5.528670E-04 --1.320550E-02 -1.856248E-04 -1.185337E-02 -3.428536E-04 -2.622196E-02 -3.774884E-04 -2.938463E-02 -6.660370E-04 -8.696000E+00 -2.521248E+01 --2.634867E-02 -2.718345E-04 -4.042613E-03 -3.367272E-03 --1.328903E-01 -8.576852E-03 --1.632965E-02 -5.577169E-04 --1.408565E-02 -1.815109E-04 -1.202519E-02 -3.685250E-04 -2.634054E-02 -3.730853E-04 -2.941341E-02 -6.479457E-04 +2.247257E+01 +1.683779E+02 1.014000E+01 -3.427460E+01 +3.427342E+01 +8.628000E+00 +2.481430E+01 +8.628000E+00 +2.481430E+01 +5.102293E-01 +8.710841E-02 +8.628000E+00 +2.481430E+01 +9.329009E-01 +2.902534E-01 +5.102293E-01 +8.710841E-02 +5.102293E-01 +8.710841E-02 +8.628000E+00 +2.481430E+01 +9.329009E-01 +2.902534E-01 +5.102293E-01 +8.710841E-02 +9.212024E+00 +2.829472E+01 +8.628000E+00 +2.481430E+01 +1.512000E+00 +7.620560E-01 +1.816851E+00 +1.102658E+00 +1.338067E+02 +5.986137E+03 +2.247257E+01 +1.683779E+02 +-1.512960E-01 +2.623972E-02 +-3.775020E-01 +1.055377E-01 +-1.916133E-01 +4.680798E-02 +2.754367E-02 +3.320008E-04 +-2.028374E-02 +1.319357E-02 +8.974271E-03 +1.681081E-03 +-1.658978E-01 +1.520448E-02 +2.878360E-01 +5.645480E-02 +1.014000E+01 +3.427342E+01 +-4.798897E-02 +1.551226E-03 +-1.818770E-01 +1.492633E-02 +-6.340651E-02 +9.011305E-03 +3.395308E-02 +4.612818E-04 +-2.640250E-02 +6.434787E-04 +-8.242639E-03 +9.516540E-04 +-8.378601E-02 +2.645988E-03 +9.567484E-02 +7.262477E-03 +8.628000E+00 +2.481430E+01 +-4.712248E-02 +1.140942E-03 +-6.431930E-02 +4.290580E-03 +-9.251642E-02 +8.134201E-03 +1.020119E-04 +1.154184E-04 +-2.994164E-02 +3.079076E-04 +2.128844E-02 +2.046549E-04 +1.637972E-02 +1.459209E-04 +4.629047E-02 +7.823267E-04 +8.628000E+00 +2.481430E+01 +-4.712248E-02 +1.140942E-03 +-6.431930E-02 +4.290580E-03 +-9.251642E-02 +8.134201E-03 +1.020119E-04 +1.154184E-04 +-2.994164E-02 +3.079076E-04 +2.128844E-02 +2.046549E-04 +1.637972E-02 +1.459209E-04 +4.629047E-02 +7.823267E-04 +1.014000E+01 +3.427342E+01 diff --git a/tests/test_natural_element/results_true.dat b/tests/test_natural_element/results_true.dat index 4b132ea37..1c8668e12 100644 --- a/tests/test_natural_element/results_true.dat +++ b/tests/test_natural_element/results_true.dat @@ -1,2 +1,2 @@ k-combined: -1.053229E+00 9.241274E-02 +1.013112E+00 2.551515E-02 diff --git a/tests/test_output/results_true.dat b/tests/test_output/results_true.dat index f2dfdeca1..5263a6b7f 100644 --- a/tests/test_output/results_true.dat +++ b/tests/test_output/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.011726E-01 1.841644E-03 +3.021779E-01 3.813358E-03 diff --git a/tests/test_particle_restart_eigval/results_true.dat b/tests/test_particle_restart_eigval/results_true.dat index a93cbb27b..bbc23fb6e 100644 --- a/tests/test_particle_restart_eigval/results_true.dat +++ b/tests/test_particle_restart_eigval/results_true.dat @@ -1,16 +1,16 @@ current batch: -1.200000E+01 +9.000000E+00 current gen: 1.000000E+00 particle id: -6.160000E+02 +5.550000E+02 run mode: 2.000000E+00 particle weight: 1.000000E+00 particle energy: -3.545295E-01 +2.831611E-01 particle xyz: -3.516323E+01 -5.400148E+01 -1.588825E+01 +4.973847E+01 6.971699E+00 -5.201827E+01 particle uvw: -4.129799E-01 7.649720E-01 4.942322E-01 +6.945105E-01 6.295355E-01 -3.483393E-01 diff --git a/tests/test_particle_restart_eigval/test_particle_restart_eigval.py b/tests/test_particle_restart_eigval/test_particle_restart_eigval.py index 64123b2e0..a9f4563d0 100644 --- a/tests/test_particle_restart_eigval/test_particle_restart_eigval.py +++ b/tests/test_particle_restart_eigval/test_particle_restart_eigval.py @@ -6,5 +6,5 @@ from testing_harness import ParticleRestartTestHarness if __name__ == '__main__': - harness = ParticleRestartTestHarness('particle_12_616.*') + harness = ParticleRestartTestHarness('particle_9_555.*') harness.main() diff --git a/tests/test_ptables_off/results_true.dat b/tests/test_ptables_off/results_true.dat index 17d6e9145..2d6511cd2 100644 --- a/tests/test_ptables_off/results_true.dat +++ b/tests/test_ptables_off/results_true.dat @@ -1,2 +1,2 @@ k-combined: -2.984064E-01 3.464413E-03 +2.998034E-01 5.227986E-03 diff --git a/tests/test_reflective_cone/results_true.dat b/tests/test_reflective_cone/results_true.dat index 60b34bf66..c8b833bff 100644 --- a/tests/test_reflective_cone/results_true.dat +++ b/tests/test_reflective_cone/results_true.dat @@ -1,2 +1,2 @@ k-combined: -2.281477E+00 5.206704E-03 +2.269987E+00 4.469683E-03 diff --git a/tests/test_reflective_cylinder/results_true.dat b/tests/test_reflective_cylinder/results_true.dat index f98c51788..0a11f3ef3 100644 --- a/tests/test_reflective_cylinder/results_true.dat +++ b/tests/test_reflective_cylinder/results_true.dat @@ -1,2 +1,2 @@ k-combined: -2.276055E+00 3.186526E-03 +2.272436E+00 7.831006E-04 diff --git a/tests/test_reflective_plane/results_true.dat b/tests/test_reflective_plane/results_true.dat index 049d45606..c5ba8e63f 100644 --- a/tests/test_reflective_plane/results_true.dat +++ b/tests/test_reflective_plane/results_true.dat @@ -1,2 +1,2 @@ k-combined: -2.281505E+00 3.254688E-03 +2.276127E+00 4.678320E-03 diff --git a/tests/test_reflective_sphere/results_true.dat b/tests/test_reflective_sphere/results_true.dat index 47aa5c763..f25a72dc9 100644 --- a/tests/test_reflective_sphere/results_true.dat +++ b/tests/test_reflective_sphere/results_true.dat @@ -1,2 +1,2 @@ k-combined: -2.280812E+00 5.087968E-03 +2.271012E+00 3.466350E-03 diff --git a/tests/test_resonance_scattering/results_true.dat b/tests/test_resonance_scattering/results_true.dat index 62b0ac223..0dda991ca 100644 --- a/tests/test_resonance_scattering/results_true.dat +++ b/tests/test_resonance_scattering/results_true.dat @@ -1,2 +1,2 @@ k-combined: -6.452021E-02 1.738736E-03 +6.842112E-02 8.480934E-04 diff --git a/tests/test_rotation/results_true.dat b/tests/test_rotation/results_true.dat index f2dfdeca1..5263a6b7f 100644 --- a/tests/test_rotation/results_true.dat +++ b/tests/test_rotation/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.011726E-01 1.841644E-03 +3.021779E-01 3.813358E-03 diff --git a/tests/test_salphabeta/results_true.dat b/tests/test_salphabeta/results_true.dat index c2cd683be..a04ee8fc8 100644 --- a/tests/test_salphabeta/results_true.dat +++ b/tests/test_salphabeta/results_true.dat @@ -1,2 +1,2 @@ k-combined: -8.418898E-01 5.633536E-03 +8.538165E-01 6.355606E-03 diff --git a/tests/test_salphabeta_multiple/results_true.dat b/tests/test_salphabeta_multiple/results_true.dat index 57e620610..593c5adc7 100644 --- a/tests/test_salphabeta_multiple/results_true.dat +++ b/tests/test_salphabeta_multiple/results_true.dat @@ -1,2 +1,2 @@ k-combined: -9.686128E-01 5.056987E-02 +9.141547E-01 2.728809E-02 diff --git a/tests/test_score_MT/results_true.dat b/tests/test_score_MT/results_true.dat index 03b91f89f..248f6657d 100644 --- a/tests/test_score_MT/results_true.dat +++ b/tests/test_score_MT/results_true.dat @@ -1,5 +1,5 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: 0.000000E+00 0.000000E+00 @@ -9,27 +9,27 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -1.107640E-02 -4.232516E-05 -1.107640E-02 -4.232516E-05 -3.509526E-01 -2.565440E-02 -1.171523E+00 -2.824070E-01 -5.592851E-04 -1.423656E-07 -5.592851E-04 -1.423656E-07 -3.027322E-02 -1.983924E-04 -1.477313E-02 -4.495633E-05 +6.261679E-03 +2.310296E-05 +6.261679E-03 +2.310296E-05 +3.434524E-01 +2.482946E-02 +1.059004E+00 +2.432555E-01 +3.828838E-04 +9.365499E-08 +3.828838E-04 +9.365499E-08 +3.226036E-02 +2.229037E-04 +1.450446E-02 +4.382852E-05 8.650696E-08 7.483455E-15 8.650696E-08 7.483455E-15 -1.097403E-04 -3.424171E-09 -6.866942E-02 -9.952916E-04 +7.312640E-05 +2.080857E-09 +6.101318E-02 +8.452067E-04 diff --git a/tests/test_score_absorption/results_true.dat b/tests/test_score_absorption/results_true.dat index dfdadbae7..bacbf26a3 100644 --- a/tests/test_score_absorption/results_true.dat +++ b/tests/test_score_absorption/results_true.dat @@ -1,20 +1,20 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: 0.000000E+00 0.000000E+00 -2.267589E+00 -1.054691E+00 -1.476133E-02 -4.485759E-05 -3.306896E-01 -2.302248E-02 +2.006479E+00 +8.808050E-01 +1.444838E-02 +4.349668E-05 +2.926865E-01 +1.944083E-02 tally 2: 0.000000E+00 0.000000E+00 -2.290000E+00 -1.070700E+00 +2.030000E+00 +8.879000E-01 0.000000E+00 0.000000E+00 -3.800000E-01 -3.820000E-02 +4.000000E-01 +4.240000E-02 diff --git a/tests/test_score_current/results_true.dat b/tests/test_score_current/results_true.dat index 09d9a8ecf..936e2d04b 100644 --- a/tests/test_score_current/results_true.dat +++ b/tests/test_score_current/results_true.dat @@ -1 +1 @@ -8f7125c9686a94f0fdbd76b1667f84b9dab60c068e23d4f2b0105ce058fa533a8a4a221355614add10d54f3b18c14af41891e0fd0593154c73894e5dcb6fe5c2 \ No newline at end of file +1e6945632c55491d4584f4976cc6f5c7340874703cfaf739dd956b7124b4260955efb5b6ba041b32536f9a74572d071e0293dced55a41ea305223f698b734c2a \ No newline at end of file diff --git a/tests/test_score_events/results_true.dat b/tests/test_score_events/results_true.dat index fd18a5aba..35ae33eb8 100644 --- a/tests/test_score_events/results_true.dat +++ b/tests/test_score_events/results_true.dat @@ -1,12 +1,12 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -5.627000E+01 -6.565251E+02 -4.892000E+01 -5.009100E+02 +5.328000E+01 +6.082750E+02 +5.594000E+01 +6.836068E+02 tally 2: -1.458000E+01 -4.391620E+01 -1.269000E+01 -3.363670E+01 +1.372000E+01 +4.018980E+01 +1.474000E+01 +4.802520E+01 diff --git a/tests/test_score_fission/results_true.dat b/tests/test_score_fission/results_true.dat index 1a3d33383..904c0d889 100644 --- a/tests/test_score_fission/results_true.dat +++ b/tests/test_score_fission/results_true.dat @@ -1,20 +1,20 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -1.089685E+00 -2.438289E-01 +9.432574E-01 +1.970463E-01 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -9.094323E-01 -1.773090E-01 +1.039280E+00 +2.345809E-01 tally 2: -1.081920E+00 -2.404883E-01 +8.953531E-01 +1.798609E-01 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -9.945760E-01 -2.073005E-01 +9.923196E-01 +2.067216E-01 diff --git a/tests/test_score_flux/results_true.dat b/tests/test_score_flux/results_true.dat index 9c21a0f3d..31e1d9292 100644 --- a/tests/test_score_flux/results_true.dat +++ b/tests/test_score_flux/results_true.dat @@ -1,15 +1,15 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -3.403102E+01 -2.393236E+02 -1.143060E+01 -2.704386E+01 -5.691243E+01 -6.685581E+02 -2.924945E+01 -1.782032E+02 -9.965051E+00 -2.067319E+01 -4.931805E+01 -5.050490E+02 +3.224218E+01 +2.217821E+02 +1.079687E+01 +2.494701E+01 +5.252579E+01 +5.951604E+02 +3.325822E+01 +2.414028E+02 +1.145800E+01 +2.880575E+01 +5.605671E+01 +6.804062E+02 diff --git a/tests/test_score_flux_yn/results_true.dat b/tests/test_score_flux_yn/results_true.dat index 8c04c7c89..2e5df97cf 100644 --- a/tests/test_score_flux_yn/results_true.dat +++ b/tests/test_score_flux_yn/results_true.dat @@ -1,448 +1,448 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -3.403102E+01 -2.393236E+02 -1.143060E+01 -2.704386E+01 -5.691243E+01 -6.685581E+02 -2.924945E+01 -1.782032E+02 -9.965051E+00 -2.067319E+01 -4.931805E+01 -5.050490E+02 +3.224218E+01 +2.217821E+02 +1.079687E+01 +2.494701E+01 +5.252579E+01 +5.951604E+02 +3.325822E+01 +2.414028E+02 +1.145800E+01 +2.880575E+01 +5.605671E+01 +6.804062E+02 tally 2: -3.403102E+01 -2.393236E+02 --3.055588E-01 -3.594044E-02 -3.171128E-01 -3.805380E-01 --7.374877E-01 -2.391349E-01 --1.621986E-01 -5.578051E-02 -4.710459E-01 -1.850595E-01 --4.839599E-01 -2.440735E-01 -1.124798E-01 -8.640649E-02 --4.976706E-01 -8.943606E-02 -1.323704E-01 -6.713903E-02 --6.954103E-02 -7.876989E-02 -1.343675E-01 -2.569171E-02 --5.205013E-01 -7.985579E-02 -2.037295E-01 -1.501360E-01 --1.290735E-01 -5.069422E-02 --2.045060E-01 -2.197889E-01 -1.307602E-01 -5.938649E-02 --3.317004E-01 -1.359233E-01 --4.347480E-01 -7.528253E-02 -7.685982E-02 -4.559715E-02 --4.668784E-02 -4.065614E-02 -1.447872E-01 -5.538956E-02 --2.027337E-01 -7.095051E-02 --4.673353E-01 -1.235371E-01 --3.321732E-01 -6.905624E-02 --3.028859E-01 -3.382353E-02 --2.320613E-01 -2.845904E-02 -8.038034E-02 -3.466746E-02 -1.766484E-01 -9.996559E-02 -3.385184E-02 -5.510769E-02 -6.952638E-02 -2.741119E-02 -3.630715E-01 -5.336447E-02 -2.876222E-01 -9.938256E-02 --3.473240E-02 -1.031412E-01 -1.280013E-01 -2.331384E-02 -1.550774E-01 -3.881493E-02 -1.143060E+01 -2.704386E+01 --1.955516E-01 -9.789273E-03 -4.070149E-02 -3.530892E-02 --1.446334E-01 -3.374966E-02 --4.072014E-02 -1.407320E-02 -1.056190E-01 -2.144988E-02 --1.491728E-01 -1.699068E-02 -3.130540E-02 -4.945783E-03 --1.706770E-01 -6.943395E-03 -6.278466E-02 -4.522701E-03 --6.491915E-02 -1.218265E-02 --6.226375E-02 -8.920919E-03 --2.647477E-01 -2.028918E-02 --9.179913E-03 -1.186941E-02 --8.959288E-02 -9.826050E-03 --4.800079E-02 -3.500548E-02 -9.919028E-02 -1.278789E-02 --1.274511E-01 -9.357943E-03 --9.037073E-02 -4.686665E-03 --7.895199E-03 -8.526809E-03 --2.071827E-02 -5.844891E-03 --1.422877E-02 -2.008170E-03 --7.787500E-02 -9.642362E-03 --6.105504E-02 -7.600775E-03 --1.249117E-01 -1.314509E-02 --9.183605E-02 -7.513215E-03 --9.171222E-02 -4.220465E-03 -8.798390E-02 -5.037483E-03 -4.366496E-02 -8.411743E-03 -1.605678E-02 -6.994511E-03 --2.179875E-02 -1.352098E-03 -1.116755E-01 -7.354424E-03 -9.995739E-02 -9.710026E-03 -3.010324E-02 -1.179938E-02 -2.175815E-02 -1.281441E-03 -2.374886E-02 -6.943432E-03 -5.691243E+01 -6.685581E+02 --7.130295E-01 -1.971869E-01 -1.138602E+00 -1.071873E+00 --1.436194E+00 -7.200870E-01 --2.384966E-01 -1.129688E-01 -8.003085E-01 -5.809429E-01 --3.499868E-01 -3.310435E-01 -2.580763E-01 -2.238385E-01 --3.576056E-01 -1.437071E-01 -2.560747E-01 -4.492224E-02 --4.006295E-01 -2.456809E-01 -8.176054E-02 -3.924768E-01 --8.105689E-01 -2.397175E-01 -3.777117E-01 -4.811523E-01 --4.932440E-01 -1.789106E-01 --3.705746E-02 -5.517840E-01 -7.049764E-01 -4.243943E-01 --4.833188E-01 -2.014189E-01 --5.420278E-01 -1.201572E-01 -7.606099E-02 -1.451071E-01 -2.244026E-01 -7.628680E-02 -2.495758E-01 -1.882655E-01 --1.373888E-01 -1.958724E-01 --3.799191E-01 -2.258678E-01 --5.909624E-01 -2.940322E-01 --6.336238E-01 -1.272552E-01 --5.544697E-01 -9.027652E-02 -4.161023E-01 -1.084744E-01 -5.550548E-01 -1.838427E-01 -3.060033E-01 -8.542356E-02 -3.623817E-01 -4.245612E-02 -4.779023E-01 -8.081477E-02 -1.089872E-01 -1.402042E-01 --1.107440E-01 -3.140479E-01 -2.333168E-01 -1.035674E-01 --5.959476E-02 -2.482914E-01 -2.924945E+01 -1.782032E+02 -5.986908E-01 -4.163713E-01 -3.376452E-01 -1.744277E-01 -1.272993E-01 -1.526084E-01 --2.551267E-01 -7.284601E-02 -4.755790E-02 -6.832796E-02 --3.425133E-01 -7.756266E-02 -3.823240E-01 -1.789133E-01 --3.767347E-01 -1.676013E-01 -1.655399E-01 -1.153056E-01 -1.432265E-01 -2.956364E-02 --2.989439E-01 -5.066565E-02 --3.226047E-02 -5.960686E-02 --9.968550E-02 -4.039270E-02 --1.235291E-02 -2.805714E-01 --7.494860E-02 -2.838999E-02 -3.042503E-02 -7.425538E-02 --1.849034E-01 -8.599532E-02 --5.209242E-01 -1.174277E-01 --2.314402E-01 -4.065974E-02 --4.179560E-01 -1.382716E-01 -1.026654E-01 -1.611177E-02 --2.270386E-01 -5.157513E-02 -7.884296E-02 -2.677093E-02 -7.284620E-01 -1.871262E-01 -1.360134E-01 -9.437335E-03 --3.088199E-01 -2.292832E-02 --2.543226E-01 -1.264440E-01 -6.256788E-02 -7.604299E-02 --3.478518E-01 -6.632508E-02 -2.842847E-01 -4.906462E-02 -1.546241E-01 -3.362908E-02 --2.247690E-01 -1.912574E-02 --3.459210E-02 -1.248892E-01 --2.204075E-01 -4.281299E-02 -2.145675E-01 -5.593188E-02 -9.965051E+00 -2.067319E+01 -2.381967E-01 -4.786935E-02 --1.924308E-02 -4.029344E-02 -3.179175E-02 -2.098033E-02 --1.652308E-02 -9.391525E-03 --5.733039E-02 -1.788395E-02 -4.942155E-02 -1.206623E-03 -1.874861E-02 -1.917059E-02 --1.179838E-01 -2.185564E-02 --9.270508E-03 -1.659002E-02 -7.496511E-02 -6.849931E-03 --1.004441E-01 -4.570271E-03 --9.899601E-02 -1.027435E-02 --9.963860E-02 -4.686519E-03 --1.740638E-02 -3.936514E-02 -2.520349E-02 -5.900520E-03 -1.227791E-03 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+2.196164E-01 +-3.032729E-01 +1.241029E-01 +-3.285269E-01 +5.276607E-02 +-4.107012E-01 +6.402858E-01 +3.357626E-01 +2.672801E-01 +1.000507E+00 +5.263322E-01 +-1.834202E-01 +9.495434E-02 +8.133484E-01 +3.011488E-01 +-4.083516E-01 +2.428630E-01 +4.032934E-01 +1.825835E-01 +-8.291267E-01 +6.773284E-01 +-2.401557E-01 +2.280331E-01 +4.325658E-01 +1.163540E-01 +6.671759E-02 +2.181769E-01 +6.984462E-01 +1.716985E-01 +7.108347E-01 +1.386394E-01 +1.709795E-01 +5.320122E-02 +-2.354809E-01 +7.105363E-02 +1.600239E-01 +9.179874E-02 +2.802111E-02 +6.149546E-02 +-4.005049E-01 +2.195356E-01 +7.914623E-01 +2.273026E-01 +3.392453E-01 +1.101813E-01 +-7.821576E-01 +1.637944E-01 +4.736782E-01 +1.531480E-01 +-5.253391E-01 +1.093913E-01 +2.235961E-01 +5.449263E-02 diff --git a/tests/test_score_kappafission/results_true.dat b/tests/test_score_kappafission/results_true.dat index f9f4c44b9..dadcdd281 100644 --- a/tests/test_score_kappafission/results_true.dat +++ b/tests/test_score_kappafission/results_true.dat @@ -1,11 +1,11 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -2.135627E+02 -9.364189E+03 +1.848110E+02 +7.563211E+03 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -1.782510E+02 -6.811324E+03 +2.035912E+02 +8.999693E+03 diff --git a/tests/test_score_nufission/results_true.dat b/tests/test_score_nufission/results_true.dat index 21d6586b6..5d0b44662 100644 --- a/tests/test_score_nufission/results_true.dat +++ b/tests/test_score_nufission/results_true.dat @@ -1,11 +1,11 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -2.879098E+00 -1.700626E+00 +2.486342E+00 +1.368793E+00 0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 -2.401881E+00 -1.235627E+00 +2.733038E+00 +1.616903E+00 diff --git a/tests/test_score_nuscatter/results_true.dat b/tests/test_score_nuscatter/results_true.dat index e2be939c7..df695d8a8 100644 --- a/tests/test_score_nuscatter/results_true.dat +++ b/tests/test_score_nuscatter/results_true.dat @@ -1,11 +1,11 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: 0.000000E+00 0.000000E+00 -1.239000E+01 -3.172630E+01 -3.570000E+00 -2.668900E+00 -4.450000E+01 -4.100412E+02 +1.169000E+01 +2.915330E+01 +3.200000E+00 +2.342600E+00 +4.064000E+01 +3.595168E+02 diff --git a/tests/test_score_nuscatter_n/results_true.dat b/tests/test_score_nuscatter_n/results_true.dat index 9b84b7078..b46a1e184 100644 --- a/tests/test_score_nuscatter_n/results_true.dat +++ b/tests/test_score_nuscatter_n/results_true.dat @@ -1,33 +1,33 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -1.239000E+01 -3.172630E+01 -1.431689E+00 -4.209133E-01 -6.192790E-01 -1.440589E-01 -4.143123E-01 -5.479770E-02 -2.942906E-01 -3.458523E-02 -3.570000E+00 -2.668900E+00 -3.298388E-01 -4.816449E-02 -3.308381E-01 -3.018261E-02 -5.366444E-02 -7.235974E-03 --7.363858E-02 -7.113489E-03 -4.450000E+01 -4.100412E+02 -2.317316E+01 -1.102855E+02 -8.679054E+00 -1.538963E+01 -7.128469E-01 -1.440027E-01 --1.172445E+00 -3.514659E-01 +1.169000E+01 +2.915330E+01 +1.247253E+00 +3.767436E-01 +5.330812E-01 +1.385083E-01 +2.987823E-01 +5.699361E-02 +2.645512E-01 +2.905381E-02 +3.200000E+00 +2.342600E+00 +3.809941E-01 +2.965326E-02 +4.319242E-01 +3.738822E-02 +9.261909E-02 +6.711328E-03 +-6.052442E-02 +7.087230E-03 +4.064000E+01 +3.595168E+02 +2.096700E+01 +9.516606E+01 +7.560566E+00 +1.248694E+01 +2.093348E-01 +4.278510E-02 +-1.449929E+00 +4.356371E-01 diff --git a/tests/test_score_nuscatter_pn/results_true.dat b/tests/test_score_nuscatter_pn/results_true.dat index 18a93153e..3c34895d9 100644 --- a/tests/test_score_nuscatter_pn/results_true.dat +++ b/tests/test_score_nuscatter_pn/results_true.dat @@ -1,24 +1,24 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -1.239000E+01 -3.172630E+01 -1.431689E+00 -4.209133E-01 -6.192790E-01 -1.440589E-01 -4.143123E-01 -5.479770E-02 -2.942906E-01 -3.458523E-02 +1.169000E+01 +2.915330E+01 +1.247253E+00 +3.767436E-01 +5.330812E-01 +1.385083E-01 +2.987823E-01 +5.699361E-02 +2.645512E-01 +2.905381E-02 tally 2: -1.239000E+01 -3.172630E+01 -1.431689E+00 -4.209133E-01 -6.192790E-01 -1.440589E-01 -4.143123E-01 -5.479770E-02 -2.942906E-01 -3.458523E-02 +1.169000E+01 +2.915330E+01 +1.247253E+00 +3.767436E-01 +5.330812E-01 +1.385083E-01 +2.987823E-01 +5.699361E-02 +2.645512E-01 +2.905381E-02 diff --git a/tests/test_score_nuscatter_yn/results_true.dat b/tests/test_score_nuscatter_yn/results_true.dat index e6ca67827..1e8e143ef 100644 --- a/tests/test_score_nuscatter_yn/results_true.dat +++ b/tests/test_score_nuscatter_yn/results_true.dat @@ -1,38 +1,38 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -1.239000E+01 -3.172630E+01 +1.169000E+01 +2.915330E+01 tally 2: -1.239000E+01 -3.172630E+01 --1.558408E-01 -1.069360E-02 --4.768057E-02 -2.298561E-02 -7.015981E-02 -1.366523E-02 --2.449791E-02 -5.899048E-03 -9.535825E-02 -6.335188E-03 --9.915129E-03 -2.116965E-03 --2.535001E-03 -2.410993E-03 -1.030312E-01 -1.128648E-02 --4.471182E-02 -6.335010E-03 -4.744793E-02 -2.215754E-03 -6.507318E-02 -2.747856E-03 --8.724368E-02 -3.500811E-03 -5.479971E-03 -2.059588E-04 --1.345855E-01 -5.547202E-03 -8.586379E-02 -3.537507E-03 +1.169000E+01 +2.915330E+01 +-2.198379E-01 +2.828670E-02 +-1.317276E-01 +9.568596E-03 +8.309792E-02 +1.155410E-02 +-2.288506E-02 +3.710542E-03 +-2.720674E-02 +1.789163E-03 +-1.323964E-02 +1.819112E-04 +8.941597E-02 +4.265616E-03 +1.516805E-01 +1.332526E-02 +-1.832782E-02 +6.611171E-03 +1.311371E-02 +2.840648E-03 +3.728365E-02 +2.866806E-03 +-5.100587E-02 +2.957146E-03 +3.388028E-02 +2.481570E-03 +-7.766921E-02 +3.129377E-03 +1.666131E-02 +3.828290E-03 diff --git a/tests/test_score_scatter/results_true.dat b/tests/test_score_scatter/results_true.dat index 9619e0f49..5f0ae8b1d 100644 --- a/tests/test_score_scatter/results_true.dat +++ b/tests/test_score_scatter/results_true.dat @@ -1,11 +1,11 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: 0.000000E+00 0.000000E+00 -1.290818E+01 -3.438677E+01 -3.136743E+00 -2.032819E+00 -4.503247E+01 -4.196453E+02 +1.223028E+01 +3.185078E+01 +2.900350E+00 +1.814004E+00 +4.059013E+01 +3.609499E+02 diff --git a/tests/test_score_scatter_n/results_true.dat b/tests/test_score_scatter_n/results_true.dat index 418eabad7..b46a1e184 100644 --- a/tests/test_score_scatter_n/results_true.dat +++ b/tests/test_score_scatter_n/results_true.dat @@ -1,33 +1,33 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -1.238000E+01 -3.168320E+01 -1.437080E+00 -4.234943E-01 -6.199204E-01 -1.441510E-01 -4.101424E-01 -5.414561E-02 -2.977431E-01 -3.433685E-02 -3.570000E+00 -2.668900E+00 -3.298388E-01 -4.816449E-02 -3.308381E-01 -3.018261E-02 -5.366444E-02 -7.235974E-03 --7.363858E-02 -7.113489E-03 -4.450000E+01 -4.100412E+02 -2.317316E+01 -1.102855E+02 -8.679054E+00 -1.538963E+01 -7.128469E-01 -1.440027E-01 --1.172445E+00 -3.514659E-01 +1.169000E+01 +2.915330E+01 +1.247253E+00 +3.767436E-01 +5.330812E-01 +1.385083E-01 +2.987823E-01 +5.699361E-02 +2.645512E-01 +2.905381E-02 +3.200000E+00 +2.342600E+00 +3.809941E-01 +2.965326E-02 +4.319242E-01 +3.738822E-02 +9.261909E-02 +6.711328E-03 +-6.052442E-02 +7.087230E-03 +4.064000E+01 +3.595168E+02 +2.096700E+01 +9.516606E+01 +7.560566E+00 +1.248694E+01 +2.093348E-01 +4.278510E-02 +-1.449929E+00 +4.356371E-01 diff --git a/tests/test_score_scatter_pn/results_true.dat b/tests/test_score_scatter_pn/results_true.dat index d6767ea03..3c34895d9 100644 --- a/tests/test_score_scatter_pn/results_true.dat +++ b/tests/test_score_scatter_pn/results_true.dat @@ -1,24 +1,24 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -1.238000E+01 -3.168320E+01 -1.437080E+00 -4.234943E-01 -6.199204E-01 -1.441510E-01 -4.101424E-01 -5.414561E-02 -2.977431E-01 -3.433685E-02 +1.169000E+01 +2.915330E+01 +1.247253E+00 +3.767436E-01 +5.330812E-01 +1.385083E-01 +2.987823E-01 +5.699361E-02 +2.645512E-01 +2.905381E-02 tally 2: -1.238000E+01 -3.168320E+01 -1.437080E+00 -4.234943E-01 -6.199204E-01 -1.441510E-01 -4.101424E-01 -5.414561E-02 -2.977431E-01 -3.433685E-02 +1.169000E+01 +2.915330E+01 +1.247253E+00 +3.767436E-01 +5.330812E-01 +1.385083E-01 +2.987823E-01 +5.699361E-02 +2.645512E-01 +2.905381E-02 diff --git a/tests/test_score_scatter_yn/results_true.dat b/tests/test_score_scatter_yn/results_true.dat index 23f56743b..9df7ea42a 100644 --- a/tests/test_score_scatter_yn/results_true.dat +++ b/tests/test_score_scatter_yn/results_true.dat @@ -1,56 +1,56 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -1.238000E+01 -3.168320E+01 +1.169000E+01 +2.915330E+01 tally 2: -1.238000E+01 -3.168320E+01 --1.570048E-01 -1.067590E-02 --4.730723E-02 -2.307294E-02 -6.490976E-02 -1.426908E-02 --2.426427E-02 -5.909294E-03 -9.534163E-02 -6.333588E-03 --1.023123E-02 -2.132217E-03 --2.609941E-03 -2.406916E-03 -1.035322E-01 -1.128320E-02 --4.271935E-02 -6.478440E-03 -4.721270E-02 -2.212864E-03 -6.453502E-02 -2.750693E-03 --8.681394E-02 -3.493602E-03 -3.052598E-03 -1.842182E-04 --1.350899E-01 -5.564227E-03 -8.846033E-02 -3.537258E-03 -5.729362E-02 -2.064207E-03 -1.780469E-02 -2.838072E-03 --4.570340E-02 -2.812380E-03 -2.213430E-02 -5.564728E-04 --3.159434E-03 -3.500419E-03 --1.547339E-02 -1.929157E-03 -6.653362E-02 -1.421509E-03 -1.226039E-02 -1.144939E-03 -5.785933E-03 -4.218074E-04 +1.169000E+01 +2.915330E+01 +-2.198379E-01 +2.828670E-02 +-1.317276E-01 +9.568596E-03 +8.309792E-02 +1.155410E-02 +-2.288506E-02 +3.710542E-03 +-2.720674E-02 +1.789163E-03 +-1.323964E-02 +1.819112E-04 +8.941597E-02 +4.265616E-03 +1.516805E-01 +1.332526E-02 +-1.832782E-02 +6.611171E-03 +1.311371E-02 +2.840648E-03 +3.728365E-02 +2.866806E-03 +-5.100587E-02 +2.957146E-03 +3.388028E-02 +2.481570E-03 +-7.766921E-02 +3.129377E-03 +1.666131E-02 +3.828290E-03 +8.102553E-02 +2.118169E-03 +6.303084E-03 +7.156173E-04 +-2.083478E-03 +2.683340E-03 +6.794806E-03 +3.912783E-04 +1.005390E-01 +2.920205E-03 +-5.332517E-02 +2.205372E-03 +-1.584725E-02 +8.984498E-04 +3.486904E-02 +6.448722E-04 +-2.420912E-02 +6.352276E-04 diff --git a/tests/test_score_total/results_true.dat b/tests/test_score_total/results_true.dat index 0838e7bae..f3aa5d89b 100644 --- a/tests/test_score_total/results_true.dat +++ b/tests/test_score_total/results_true.dat @@ -1,11 +1,11 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: 0.000000E+00 0.000000E+00 -1.517577E+01 -4.747271E+01 -3.151504E+00 -2.051857E+00 -4.536316E+01 -4.258781E+02 +1.423676E+01 +4.330937E+01 +2.914798E+00 +1.831649E+00 +4.088282E+01 +3.662539E+02 diff --git a/tests/test_score_total_yn/results_true.dat b/tests/test_score_total_yn/results_true.dat index b2dcd39e1..bcfdb9080 100644 --- a/tests/test_score_total_yn/results_true.dat +++ b/tests/test_score_total_yn/results_true.dat @@ -1,14 +1,14 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: 0.000000E+00 0.000000E+00 -1.517577E+01 -4.747271E+01 -3.151504E+00 -2.051857E+00 -4.536316E+01 -4.258781E+02 +1.423676E+01 +4.330937E+01 +2.914798E+00 +1.831649E+00 +4.088282E+01 +3.662539E+02 tally 2: 0.000000E+00 0.000000E+00 @@ -110,106 +110,106 @@ tally 2: 0.000000E+00 0.000000E+00 0.000000E+00 -8.795501E-01 -1.600341E-01 --1.530661E-02 -5.215322E-04 -1.571095E-02 -9.166057E-04 -7.226990E-03 -3.683499E-04 --2.456165E-02 -1.571441E-04 -1.387449E-02 -5.600648E-04 --2.186870E-02 -2.081164E-04 --1.106814E-02 -1.065144E-04 --4.579593E-03 -2.008225E-04 -7.573253E-03 -2.493075E-04 --1.505016E-02 -1.451400E-04 -1.503792E-02 -9.539029E-05 --1.183668E-02 -1.741393E-04 -4.060912E-03 -5.890591E-05 -1.789747E-02 -8.239749E-05 --2.168438E-02 -1.555757E-04 --1.045826E-02 -8.108402E-05 -1.227413E-02 -2.502871E-04 --2.806122E-02 -1.886120E-04 --4.918718E-03 -2.129038E-04 --1.014729E-02 -6.914145E-05 --5.873760E-03 -2.229738E-04 -6.666511E-03 -1.394147E-04 --3.245528E-03 -1.550876E-04 --1.037659E-02 -2.163837E-04 -1.517577E+01 -4.747271E+01 --2.463504E-01 -2.376091E-02 -7.930151E-02 -3.516796E-02 --1.611736E-01 -2.658129E-02 --9.124923E-02 -1.181443E-02 -2.766258E-01 -2.310767E-02 --2.269608E-01 -3.593659E-02 --5.345296E-02 -1.169733E-02 --1.838169E-01 -1.625334E-02 --7.883035E-02 -8.514293E-03 --4.922148E-02 -7.767910E-03 -1.144559E-01 -4.638553E-03 --2.027207E-01 -2.158672E-02 -5.449222E-02 -1.287150E-02 -5.384229E-02 -6.688120E-03 --8.231311E-02 -2.743044E-02 -1.172790E-02 -1.089457E-02 --1.545389E-01 -2.655167E-02 --2.290221E-01 -1.443721E-02 -2.773254E-02 -1.070478E-02 --2.522703E-02 -1.136507E-02 --1.287564E-02 -4.969443E-03 -3.471629E-02 -7.559603E-03 --2.261509E-01 -2.383142E-02 --1.463402E-01 -1.526988E-02 +7.812543E-01 +1.349265E-01 +-7.005988E-03 +2.198486E-04 +3.237937E-02 +7.569491E-04 +-3.865436E-04 +4.048167E-04 +-1.003877E-02 +3.195619E-04 +3.738815E-03 +3.506174E-04 +-2.549288E-02 +3.086810E-04 +1.693002E-02 +1.255885E-04 +3.059341E-03 +1.971678E-04 +9.247344E-03 +2.402855E-04 +6.618469E-04 +1.639025E-04 +1.992953E-02 +1.365376E-04 +3.262256E-03 +1.341040E-05 +2.864166E-03 +4.394787E-05 +1.494351E-03 +1.001007E-04 +-1.091424E-02 +1.221030E-04 +9.875992E-03 +1.141979E-04 +1.263647E-02 +2.400023E-04 +-2.944398E-03 +1.246417E-04 +1.970051E-03 +1.600160E-04 +6.148931E-03 +4.774182E-05 +1.107728E-02 +1.095420E-04 +1.382599E-02 +1.537793E-04 +-1.296297E-02 +1.392028E-04 +-1.479385E-02 +1.650074E-04 +1.423676E+01 +4.330937E+01 +-2.802155E-01 +3.016146E-02 +-8.009314E-02 +4.251899E-02 +-7.383773E-02 +1.547362E-02 +-1.274422E-01 +2.290306E-02 +1.370426E-01 +1.002935E-02 +-2.607280E-01 +3.414307E-02 +1.497421E-02 +2.944540E-03 +-2.866477E-02 +9.113662E-03 +-3.949118E-02 +4.437767E-03 +2.283116E-01 +1.792907E-02 +1.334103E-01 +1.587762E-02 +-3.139096E-01 +2.330713E-02 +1.025884E-03 +5.754195E-03 +1.099489E-01 +1.861634E-02 +-7.863729E-02 +2.276108E-02 +1.219111E-01 +1.363203E-02 +-1.261893E-01 +1.937908E-02 +-1.995428E-01 +1.383344E-02 +8.803472E-02 +3.742219E-03 +1.501143E-01 +1.288322E-02 +4.522115E-02 +8.283014E-03 +1.113588E-01 +8.523967E-03 +-1.820582E-01 +1.648932E-02 +-1.121108E-01 +1.059879E-02 0.000000E+00 0.000000E+00 0.000000E+00 @@ -260,56 +260,56 @@ tally 2: 0.000000E+00 0.000000E+00 0.000000E+00 -3.151504E+00 -2.051857E+00 --4.923938E-02 -1.416150E-03 --1.041702E-02 -8.114498E-04 --3.212977E-02 -2.419393E-03 -2.557299E-02 -1.124488E-03 -4.083178E-02 -1.351219E-03 --3.910818E-02 -8.908208E-04 -5.659008E-03 -4.488733E-04 --1.625829E-02 -2.325228E-04 -2.554220E-02 -7.666018E-04 --2.251672E-02 -7.703442E-04 --8.302474E-03 -2.748216E-04 --7.692439E-02 -2.167893E-03 -7.267774E-03 -7.781907E-04 -6.821338E-03 -9.518920E-04 --2.203951E-02 -2.214610E-03 -2.052514E-02 -3.756195E-04 --4.158575E-02 -9.330262E-04 --3.000932E-02 -4.584914E-04 --2.247072E-02 -2.519845E-04 -1.589401E-02 -2.302726E-04 --7.793787E-04 -1.588955E-04 --4.634907E-03 -5.395803E-04 --1.193817E-02 -1.674419E-04 --1.682320E-02 -8.389254E-04 +2.914798E+00 +1.831649E+00 +-3.213884E-02 +1.391026E-03 +-1.124311E-02 +2.059984E-03 +-1.372399E-02 +2.990198E-03 +-6.931800E-03 +1.073303E-03 +-5.448993E-03 +3.542504E-04 +-7.264172E-02 +1.742045E-03 +1.526380E-02 +5.962297E-04 +1.576474E-02 +5.335071E-04 +2.028206E-02 +2.915489E-04 +4.014298E-02 +4.285950E-04 +8.228146E-03 +6.388002E-04 +-8.183952E-02 +2.031634E-03 +1.014523E-02 +1.159653E-03 +9.321030E-03 +7.480844E-04 +-3.156017E-02 +2.064357E-03 +3.606483E-02 +4.060244E-04 +-3.866234E-02 +1.046100E-03 +-5.723297E-02 +1.042437E-03 +2.894838E-02 +2.922848E-04 +-1.529225E-03 +2.472179E-04 +9.484410E-03 +4.172637E-04 +-4.442548E-04 +2.518508E-04 +-3.065480E-02 +3.571846E-04 +-6.519117E-03 +1.779322E-04 0.000000E+00 0.000000E+00 0.000000E+00 @@ -360,53 +360,53 @@ tally 2: 0.000000E+00 0.000000E+00 0.000000E+00 -4.536316E+01 -4.258781E+02 --6.747275E-01 -3.006113E-01 -5.302096E-01 -4.167797E-01 --4.347270E-01 -3.702158E-01 --7.344613E-02 -5.940699E-02 -1.081217E+00 -4.070812E-01 --3.172368E-02 -3.124338E-02 -2.656115E-01 -8.561866E-02 --1.286933E-01 -8.347414E-02 -1.258195E-01 -3.329577E-02 --3.751107E-01 -9.007513E-02 -4.283879E-01 -1.067035E-01 --3.467870E-01 -6.788988E-02 -4.218567E-02 -4.465188E-02 -6.876561E-02 -5.655954E-02 --1.116047E-01 -1.073179E-01 -4.077067E-01 -1.148942E-01 --3.218725E-01 -4.739201E-02 --4.297438E-01 -9.739104E-02 -2.199014E-01 -2.328443E-02 -6.007636E-01 -1.194137E-01 --2.194826E-01 -5.017106E-02 -2.266133E-01 -1.131899E-01 -7.161662E-04 -3.345992E-02 --1.987041E-01 -1.381432E-01 +4.088282E+01 +3.662539E+02 +-9.859591E-01 +2.743013E-01 +2.392244E-01 +3.795971E-01 +-3.389717E-01 +7.054539E-01 +-1.673679E-01 +1.081377E-01 +2.918680E-01 +7.161035E-02 +-5.627453E-01 +9.124299E-02 +7.185542E-01 +2.062140E-01 +8.533956E-02 +3.649126E-02 +7.630639E-02 +1.623523E-02 +3.785290E-02 +4.181389E-02 +1.388919E-01 +1.307834E-01 +-2.682812E-01 +6.653584E-02 +7.151084E-02 +3.466772E-02 +6.941393E-02 +2.821800E-02 +2.392050E-02 +1.132504E-01 +3.749985E-01 +8.337209E-02 +-2.998887E-01 +6.767226E-02 +-3.629285E-01 +7.246083E-02 +3.989685E-01 +4.378581E-02 +1.330115E-01 +2.634398E-02 +2.649739E-01 +4.300042E-02 +5.793351E-01 +7.399884E-02 +-2.236528E-01 +3.130205E-02 +-3.695818E-01 +4.703480E-02 diff --git a/tests/test_seed/results_true.dat b/tests/test_seed/results_true.dat index 860e9e9af..df79ce1ce 100644 --- a/tests/test_seed/results_true.dat +++ b/tests/test_seed/results_true.dat @@ -1,2 +1,2 @@ k-combined: -2.984828E-01 5.293550E-03 +2.951164E-01 2.504580E-03 diff --git a/tests/test_source_angle_mono/results_true.dat b/tests/test_source_angle_mono/results_true.dat index 1aca9a505..42e948758 100644 --- a/tests/test_source_angle_mono/results_true.dat +++ b/tests/test_source_angle_mono/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.034005E-01 5.499077E-03 +2.964943E-01 1.201478E-02 diff --git a/tests/test_source_energy_maxwell/results_true.dat b/tests/test_source_energy_maxwell/results_true.dat index 349c65ef9..37b8b36b9 100644 --- a/tests/test_source_energy_maxwell/results_true.dat +++ b/tests/test_source_energy_maxwell/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.008495E-01 6.113736E-03 +2.886671E-01 7.534631E-03 diff --git a/tests/test_source_energy_mono/results_true.dat b/tests/test_source_energy_mono/results_true.dat index b7af42bca..029376bf3 100644 --- a/tests/test_source_energy_mono/results_true.dat +++ b/tests/test_source_energy_mono/results_true.dat @@ -1,2 +1,2 @@ k-combined: -2.964207E-01 7.263112E-03 +3.002731E-01 7.561170E-03 diff --git a/tests/test_source_file/results_true.dat b/tests/test_source_file/results_true.dat index 738a15c58..fee61dda2 100644 --- a/tests/test_source_file/results_true.dat +++ b/tests/test_source_file/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.031470E-01 4.441814E-03 +2.962911E-01 4.073420E-03 diff --git a/tests/test_source_point/results_true.dat b/tests/test_source_point/results_true.dat index 040f4e188..fe9a0d78d 100644 --- a/tests/test_source_point/results_true.dat +++ b/tests/test_source_point/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.025384E-01 4.682677E-03 +3.041148E-01 4.558319E-03 diff --git a/tests/test_sourcepoint_latest/results_true.dat b/tests/test_sourcepoint_latest/results_true.dat index f2dfdeca1..5263a6b7f 100644 --- a/tests/test_sourcepoint_latest/results_true.dat +++ b/tests/test_sourcepoint_latest/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.011726E-01 1.841644E-03 +3.021779E-01 3.813358E-03 diff --git a/tests/test_sourcepoint_restart/results_true.dat b/tests/test_sourcepoint_restart/results_true.dat index 917fc0cdf..0e4eef9a9 100644 --- a/tests/test_sourcepoint_restart/results_true.dat +++ b/tests/test_sourcepoint_restart/results_true.dat @@ -1,16 +1,116 @@ k-combined: -3.011726E-01 1.841644E-03 +3.021779E-01 3.813358E-03 tally 1: -1.200000E-02 -4.000000E-05 -8.118392E-03 -1.773579E-05 -3.683496E-03 -4.911153E-06 -1.507354E-03 -2.420229E-06 -6.245016E-03 -9.775028E-06 +7.000000E-03 +2.100000E-05 +1.127639E-03 +7.464355E-07 +-1.264355E-03 +1.192757E-06 +8.769846E-04 +1.117508E-06 +3.359153E-03 +4.366438E-06 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +6.107648E-04 +3.730336E-07 +1.000000E-03 +1.000000E-06 +6.713061E-04 +4.506518E-07 +1.759778E-04 +3.096817E-08 +-2.506458E-04 +6.282332E-08 +6.069794E-04 +3.684240E-07 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +7.000000E-03 +1.500000E-05 +4.398928E-03 +8.198908E-06 +1.784486E-03 +3.422315E-06 +8.494423E-04 +9.262242E-07 +4.566637E-03 +5.646039E-06 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +6.069794E-04 +3.684240E-07 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +3.000000E-03 +3.000000E-06 +-1.419189E-03 +9.791601E-07 +-3.125982E-05 +5.086129E-07 +3.291570E-04 +1.943609E-07 +1.525426E-03 +8.346311E-07 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -23,34 +123,254 @@ tally 1: 0.000000E+00 1.000000E-03 1.000000E-06 --6.834146E-04 -4.670555E-07 -2.005832E-04 -4.023363E-08 -2.271406E-04 -5.159283E-08 -1.822902E-03 -3.322972E-06 -3.000000E-03 -9.000000E-06 -2.089393E-03 -4.365565E-06 -1.135864E-03 -1.290186E-06 -8.092128E-04 -6.548254E-07 +-1.542107E-05 +2.378095E-10 +-4.996433E-04 +2.496434E-07 +2.312244E-05 +5.346472E-10 +3.053824E-04 +9.325841E-08 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +2.000000E-02 +8.600000E-05 +3.995253E-03 +1.648172E-05 +3.349403E-03 +1.166653E-05 +4.208940E-03 +7.077664E-06 +1.033905E-02 +2.197265E-05 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +6.029991E-04 +1.818050E-07 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 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+6.015373E-04 +3.618471E-07 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 0.000000E+00 0.000000E+00 1.300000E-02 -5.100000E-05 -4.806354E-03 -1.638996E-05 -2.497355E-03 -3.759321E-06 -2.012128E-03 -2.901025E-06 -6.823095E-03 -1.298557E-05 +5.300000E-05 +6.763364E-03 +1.445064E-05 +2.970216E-03 +3.071874E-06 +2.622002E-03 +3.547897E-06 +5.177618E-03 +8.040228E-06 0.000000E+00 0.000000E+00 0.000000E+00 @@ -59,8 +379,688 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -5.993246E-04 -1.796295E-07 +3.007686E-04 +9.046177E-08 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +3.102008E-04 +9.622454E-08 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 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0.000000E+00 0.000000E+00 tally 2: -5.604521E-01 -6.286639E-02 -6.095321E-01 -7.435628E-02 -3.539776E+00 -2.507806E+00 -3.963740E+01 -3.144698E+02 +5.720364E-01 +6.548043E-02 +6.217988E-01 +7.736906E-02 +3.624477E+00 +2.628737E+00 +4.047526E+01 +3.278231E+02 diff --git a/tests/test_statepoint_batch/results_true.dat b/tests/test_statepoint_batch/results_true.dat index 786fd5546..95b536997 100644 --- a/tests/test_statepoint_batch/results_true.dat +++ b/tests/test_statepoint_batch/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.109090E-01 5.807935E-03 +3.051173E-01 6.930168E-04 diff --git a/tests/test_statepoint_interval/results_true.dat b/tests/test_statepoint_interval/results_true.dat index f2dfdeca1..5263a6b7f 100644 --- a/tests/test_statepoint_interval/results_true.dat +++ b/tests/test_statepoint_interval/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.011726E-01 1.841644E-03 +3.021779E-01 3.813358E-03 diff --git a/tests/test_statepoint_restart/results_true.dat b/tests/test_statepoint_restart/results_true.dat index 378d07639..7fb39ef0a 100644 --- a/tests/test_statepoint_restart/results_true.dat +++ b/tests/test_statepoint_restart/results_true.dat @@ -1,16 +1,36 @@ k-combined: 0.000000E+00 0.000000E+00 tally 1: -6.000000E-03 -2.600000E-05 -3.531902E-03 -1.021953E-05 -9.975346E-04 -1.809348E-06 -1.606025E-04 -5.146498E-07 -3.612566E-03 -7.304701E-06 +1.000000E-03 +1.000000E-06 +6.655302E-04 +4.429305E-07 +1.643958E-04 +2.702597E-08 +-2.613362E-04 +6.829663E-08 +9.306024E-04 +8.660208E-07 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 0.000000E+00 0.000000E+00 0.000000E+00 @@ -23,2034 +43,174 @@ tally 1: 0.000000E+00 1.000000E-03 1.000000E-06 --6.834146E-04 -4.670555E-07 -2.005832E-04 -4.023363E-08 -2.271406E-04 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+1.791545E-04 +5.297145E-08 +1.386068E-03 +1.737839E-06 +3.054847E-03 +4.667158E-06 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +3.007686E-04 +9.046177E-08 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +2.000000E-03 +4.000000E-06 +1.083160E-03 +1.173236E-06 +-4.570050E-05 +2.088536E-09 +-6.290949E-04 +3.957604E-07 +6.204016E-04 +3.848982E-07 0.000000E+00 0.000000E+00 0.000000E+00 @@ -2243,14 +1923,14 @@ tally 1: 0.000000E+00 6.000000E-03 2.000000E-05 --2.695842E-04 -1.341496E-06 -1.562492E-03 -1.831644E-06 --7.471975E-04 -2.484564E-06 -2.388989E-03 -3.013861E-06 +2.716180E-03 +5.893679E-06 +1.554292E-03 +1.376524E-06 +7.264867E-04 +1.331497E-06 +3.045415E-03 +4.796216E-06 0.000000E+00 0.000000E+00 0.000000E+00 @@ -2281,16 +1961,16 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -2.000000E-03 -4.000000E-06 -1.468316E-03 -2.155952E-06 -6.405092E-04 -4.102520E-07 --1.375320E-04 -1.891505E-08 -1.198649E-03 -7.185180E-07 +7.000000E-03 +2.500000E-05 +9.648146E-04 +5.981145E-07 +4.634865E-05 +7.955048E-07 +-1.328560E-04 +3.379815E-07 +3.355616E-03 +5.662237E-06 0.000000E+00 0.000000E+00 0.000000E+00 @@ -2299,8 +1979,328 @@ tally 1: 0.000000E+00 0.000000E+00 0.000000E+00 -2.955076E-04 -8.732472E-08 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +0.000000E+00 +3.000000E-03 +5.000000E-06 +1.289998E-03 +8.380263E-07 +-3.762753E-05 +1.288533E-07 +-2.613682E-04 +4.197617E-08 +1.221939E-03 +7.467452E-07 +0.000000E+00 +0.000000E+00 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+0.000000E+00 +0.000000E+00 +3.102008E-04 +9.622454E-08 0.000000E+00 0.000000E+00 0.000000E+00 @@ -2323,14 +2323,14 @@ tally 1: 0.000000E+00 1.000000E-03 1.000000E-06 -9.489856E-04 -9.005736E-07 -8.508605E-04 -7.239635E-07 -7.131001E-04 -5.085118E-07 -2.955076E-04 -8.732472E-08 +1.590395E-04 +2.529356E-08 +-4.620597E-04 +2.134991E-07 +-2.285026E-04 +5.221342E-08 +3.102008E-04 +9.622454E-08 0.000000E+00 0.000000E+00 0.000000E+00 @@ -2402,11 +2402,11 @@ tally 1: 0.000000E+00 0.000000E+00 tally 2: -2.181843E-01 -2.381339E-02 -2.370439E-01 -2.810520E-02 -1.375356E+00 -9.460863E-01 -1.543948E+01 -1.192513E+02 +2.288800E-01 +2.621372E-02 +2.489848E-01 +3.102301E-02 +1.451035E+00 +1.053707E+00 +1.618797E+01 +1.311489E+02 diff --git a/tests/test_statepoint_sourcesep/results_true.dat b/tests/test_statepoint_sourcesep/results_true.dat index f2dfdeca1..5263a6b7f 100644 --- a/tests/test_statepoint_sourcesep/results_true.dat +++ b/tests/test_statepoint_sourcesep/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.011726E-01 1.841644E-03 +3.021779E-01 3.813358E-03 diff --git a/tests/test_survival_biasing/results_true.dat b/tests/test_survival_biasing/results_true.dat index 0f3509e44..a97654cfa 100644 --- a/tests/test_survival_biasing/results_true.dat +++ b/tests/test_survival_biasing/results_true.dat @@ -1,2 +1,2 @@ k-combined: -1.025211E+00 1.372397E-02 +9.997733E-01 2.995572E-02 diff --git a/tests/test_tally_assumesep/results_true.dat b/tests/test_tally_assumesep/results_true.dat index a2f3586ae..4835227f2 100644 --- a/tests/test_tally_assumesep/results_true.dat +++ b/tests/test_tally_assumesep/results_true.dat @@ -1,11 +1,11 @@ k-combined: -1.093844E+00 1.626801E-02 +1.005983E+00 2.248579E-02 tally 1: -1.517577E+01 -4.747271E+01 +1.423676E+01 +4.330937E+01 tally 2: -3.151504E+00 -2.051857E+00 +2.914798E+00 +1.831649E+00 tally 3: -4.536316E+01 -4.258781E+02 +4.088282E+01 +3.662539E+02 diff --git a/tests/test_trace/results_true.dat b/tests/test_trace/results_true.dat index f2dfdeca1..5263a6b7f 100644 --- a/tests/test_trace/results_true.dat +++ b/tests/test_trace/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.011726E-01 1.841644E-03 +3.021779E-01 3.813358E-03 diff --git a/tests/test_translation/results_true.dat b/tests/test_translation/results_true.dat index f2dfdeca1..5263a6b7f 100644 --- a/tests/test_translation/results_true.dat +++ b/tests/test_translation/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.011726E-01 1.841644E-03 +3.021779E-01 3.813358E-03 diff --git a/tests/test_trigger_batch_interval/results_true.dat b/tests/test_trigger_batch_interval/results_true.dat index 65fa51bb4..c901e1e54 100644 --- a/tests/test_trigger_batch_interval/results_true.dat +++ b/tests/test_trigger_batch_interval/results_true.dat @@ -1,28 +1,28 @@ k-combined: -9.851940E-01 4.283950E-03 +9.875001E-01 3.961945E-03 tally 1: -1.972289E+01 -2.779778E+01 -4.489781E+00 -1.440247E+00 -4.356175E+00 -1.355797E+00 -1.523311E+01 -1.658397E+01 -1.972289E+01 -2.779778E+01 -4.489781E+00 -1.440247E+00 -4.356175E+00 -1.355797E+00 -1.523311E+01 -1.658397E+01 +2.128147E+01 +3.021699E+01 +4.842434E+00 +1.563989E+00 +4.695086E+00 +1.470132E+00 +1.643904E+01 +1.803258E+01 +2.128147E+01 +3.021699E+01 +4.842434E+00 +1.563989E+00 +4.695086E+00 +1.470132E+00 +1.643904E+01 +1.803258E+01 tally 2: -1.972289E+01 -2.779778E+01 -4.489781E+00 -1.440247E+00 -4.356175E+00 -1.355797E+00 -1.523311E+01 -1.658397E+01 +2.128147E+01 +3.021699E+01 +4.842434E+00 +1.563989E+00 +4.695086E+00 +1.470132E+00 +1.643904E+01 +1.803258E+01 diff --git a/tests/test_trigger_batch_interval/settings.xml b/tests/test_trigger_batch_interval/settings.xml index d7afd9231..b8e1e9c96 100644 --- a/tests/test_trigger_batch_interval/settings.xml +++ b/tests/test_trigger_batch_interval/settings.xml @@ -1,15 +1,15 @@ - 10 + 15 5 1000 std_dev - 0.00445 + 0.004 - + true 30 diff --git a/tests/test_trigger_batch_interval/test_trigger_batch_interval.py b/tests/test_trigger_batch_interval/test_trigger_batch_interval.py index d5e176fea..e5c5b54b6 100644 --- a/tests/test_trigger_batch_interval/test_trigger_batch_interval.py +++ b/tests/test_trigger_batch_interval/test_trigger_batch_interval.py @@ -6,5 +6,5 @@ from testing_harness import TestHarness if __name__ == '__main__': - harness = TestHarness('statepoint.19.*', True) + harness = TestHarness('statepoint.20.*', True) harness.main() diff --git a/tests/test_trigger_no_batch_interval/results_true.dat b/tests/test_trigger_no_batch_interval/results_true.dat index 65fa51bb4..d06a91646 100644 --- a/tests/test_trigger_no_batch_interval/results_true.dat +++ b/tests/test_trigger_no_batch_interval/results_true.dat @@ -1,28 +1,28 @@ k-combined: -9.851940E-01 4.283950E-03 +9.853099E-01 3.825057E-03 tally 1: -1.972289E+01 -2.779778E+01 -4.489781E+00 -1.440247E+00 -4.356175E+00 -1.355797E+00 -1.523311E+01 -1.658397E+01 -1.972289E+01 -2.779778E+01 -4.489781E+00 -1.440247E+00 -4.356175E+00 -1.355797E+00 -1.523311E+01 -1.658397E+01 +2.409492E+01 +3.417475E+01 +5.477076E+00 +1.765385E+00 +5.309347E+00 +1.658803E+00 +1.861784E+01 +2.040621E+01 +2.409492E+01 +3.417475E+01 +5.477076E+00 +1.765385E+00 +5.309347E+00 +1.658803E+00 +1.861784E+01 +2.040621E+01 tally 2: -1.972289E+01 -2.779778E+01 -4.489781E+00 -1.440247E+00 -4.356175E+00 -1.355797E+00 -1.523311E+01 -1.658397E+01 +2.409492E+01 +3.417475E+01 +5.477076E+00 +1.765385E+00 +5.309347E+00 +1.658803E+00 +1.861784E+01 +2.040621E+01 diff --git a/tests/test_trigger_no_batch_interval/settings.xml b/tests/test_trigger_no_batch_interval/settings.xml index 5ceff1082..5412af35f 100644 --- a/tests/test_trigger_no_batch_interval/settings.xml +++ b/tests/test_trigger_no_batch_interval/settings.xml @@ -1,15 +1,15 @@ - 10 + 15 5 1000 std_dev - 0.00445 + 0.004 - + true 30 diff --git a/tests/test_trigger_no_batch_interval/test_trigger_no_batch_interval.py b/tests/test_trigger_no_batch_interval/test_trigger_no_batch_interval.py index d5e176fea..ff19e3d08 100644 --- a/tests/test_trigger_no_batch_interval/test_trigger_no_batch_interval.py +++ b/tests/test_trigger_no_batch_interval/test_trigger_no_batch_interval.py @@ -6,5 +6,5 @@ from testing_harness import TestHarness if __name__ == '__main__': - harness = TestHarness('statepoint.19.*', True) + harness = TestHarness('statepoint.22.*', True) harness.main() diff --git a/tests/test_trigger_no_status/results_true.dat b/tests/test_trigger_no_status/results_true.dat index b9dc78dd0..0b541099b 100644 --- a/tests/test_trigger_no_status/results_true.dat +++ b/tests/test_trigger_no_status/results_true.dat @@ -1,28 +1,28 @@ k-combined: -9.809303E-01 7.264435E-03 +9.906276E-01 1.800527E-03 tally 1: -7.031241E+00 -9.892232E+00 -1.599216E+00 -5.115987E-01 -1.550710E+00 -4.810241E-01 -5.432025E+00 -5.904811E+00 -7.031241E+00 -9.892232E+00 -1.599216E+00 -5.115987E-01 -1.550710E+00 -4.810241E-01 -5.432025E+00 -5.904811E+00 +7.043320E+00 +9.922203E+00 +1.610208E+00 +5.185662E-01 +1.564118E+00 +4.893096E-01 +5.433111E+00 +5.904259E+00 +7.043320E+00 +9.922203E+00 +1.610208E+00 +5.185662E-01 +1.564118E+00 +4.893096E-01 +5.433111E+00 +5.904259E+00 tally 2: -7.031241E+00 -9.892232E+00 -1.599216E+00 -5.115987E-01 -1.550710E+00 -4.810241E-01 -5.432025E+00 -5.904811E+00 +7.043320E+00 +9.922203E+00 +1.610208E+00 +5.185662E-01 +1.564118E+00 +4.893096E-01 +5.433111E+00 +5.904259E+00 diff --git a/tests/test_trigger_tallies/results_true.dat b/tests/test_trigger_tallies/results_true.dat index 86b1c14d5..0519260dd 100644 --- a/tests/test_trigger_tallies/results_true.dat +++ b/tests/test_trigger_tallies/results_true.dat @@ -1,28 +1,28 @@ k-combined: -9.824135E-01 6.844127E-03 +9.875396E-01 4.095985E-03 tally 1: -1.408810E+01 -1.985836E+01 -3.199600E+00 -1.024050E+00 -3.102648E+00 -9.629173E-01 -1.088850E+01 -1.186391E+01 -1.408810E+01 -1.985836E+01 -3.199600E+00 -1.024050E+00 -3.102648E+00 -9.629173E-01 -1.088850E+01 -1.186391E+01 +1.415943E+01 +2.006888E+01 +3.225529E+00 +1.040975E+00 +3.128858E+00 +9.794019E-01 +1.093390E+01 +1.196901E+01 +1.415943E+01 +2.006888E+01 +3.225529E+00 +1.040975E+00 +3.128858E+00 +9.794019E-01 +1.093390E+01 +1.196901E+01 tally 2: -1.408810E+01 -1.985836E+01 -3.199600E+00 -1.024050E+00 -3.102648E+00 -9.629173E-01 -1.088850E+01 -1.186391E+01 +1.415943E+01 +2.006888E+01 +3.225529E+00 +1.040975E+00 +3.128858E+00 +9.794019E-01 +1.093390E+01 +1.196901E+01 diff --git a/tests/test_trigger_tallies/settings.xml b/tests/test_trigger_tallies/settings.xml index c6d986ce8..895c0ee72 100644 --- a/tests/test_trigger_tallies/settings.xml +++ b/tests/test_trigger_tallies/settings.xml @@ -6,10 +6,10 @@ 1000 std_dev - 0.02 + 0.001 - + true 15 diff --git a/tests/test_uniform_fs/results_true.dat b/tests/test_uniform_fs/results_true.dat index eb3d0e715..a29a363b2 100644 --- a/tests/test_uniform_fs/results_true.dat +++ b/tests/test_uniform_fs/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.623468E-01 4.795863E-03 +3.546115E-01 2.982307E-03 diff --git a/tests/test_union_energy_grids/results_true.dat b/tests/test_union_energy_grids/results_true.dat index 05cda2e98..9556a981b 100644 --- a/tests/test_union_energy_grids/results_true.dat +++ b/tests/test_union_energy_grids/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.215828E-01 2.966835E-03 +3.155788E-01 7.559348E-03 diff --git a/tests/test_universe/results_true.dat b/tests/test_universe/results_true.dat index f2dfdeca1..5263a6b7f 100644 --- a/tests/test_universe/results_true.dat +++ b/tests/test_universe/results_true.dat @@ -1,2 +1,2 @@ k-combined: -3.011726E-01 1.841644E-03 +3.021779E-01 3.813358E-03 diff --git a/tests/test_void/results_true.dat b/tests/test_void/results_true.dat index 921d07692..4e99b8676 100644 --- a/tests/test_void/results_true.dat +++ b/tests/test_void/results_true.dat @@ -1,2 +1,2 @@ k-combined: -1.069802E+00 2.223092E-02 +1.045350E+00 2.750547E-02 From fa02c7eb29735f09f3344392d5ae717b768732d5 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Tue, 4 Aug 2015 09:47:29 +1200 Subject: [PATCH 34/43] Update documentation to reflect creation of secondary neutrons --- docs/source/methods/physics.rst | 10 +++++----- 1 file changed, 5 insertions(+), 5 deletions(-) diff --git a/docs/source/methods/physics.rst b/docs/source/methods/physics.rst index ed10b3234..d0a6a2c99 100644 --- a/docs/source/methods/physics.rst +++ b/docs/source/methods/physics.rst @@ -187,11 +187,11 @@ secondary photons from nuclear de-excitation are tracked in OpenMC. ------------------------ These types of reactions are just treated as inelastic scattering and as such -are subject to the same procedure as described in -:ref:`inelastic-scatter`. Rather than tracking multiple secondary neutrons, the -weight of the outgoing neutron is multiplied by the number of secondary -neutrons, e.g. for :math:`(n,2n)`, only one outgoing neutron is tracked but its -weight is doubled. +are subject to the same procedure as described in :ref:`inelastic-scatter`. For +reactions with integral multiplicity, e.g., :math:`(n,2n)`, an appropriate +number of secondary neutrons are created. For reactions that have a multiplicity +given as a function of the incoming neutron energy (which occasionally occurs +for MT=5), the weight of the outgoing neutron is multiplied by the multiplcity. .. _fission: From 2ce198257789e65acd9030a3954525953745ca64 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Thu, 20 Aug 2015 13:47:13 +0700 Subject: [PATCH 35/43] Extend particle track file format to include tracks from secondary particles --- scripts/openmc-track-to-vtk | 53 ++++++++++++++++--------- src/track_output.F90 | 77 +++++++++++++++++++++++++++++-------- src/tracking.F90 | 5 ++- 3 files changed, 101 insertions(+), 34 deletions(-) diff --git a/scripts/openmc-track-to-vtk b/scripts/openmc-track-to-vtk index 8db57e2a3..f44b3871a 100755 --- a/scripts/openmc-track-to-vtk +++ b/scripts/openmc-track-to-vtk @@ -1,4 +1,4 @@ -#!/usr/bin/env python2 +#!/usr/bin/env python """Convert binary particle track to VTK poly data. Usage information can be obtained by running 'track.py --help': @@ -64,26 +64,43 @@ def main(): for fname in args.input: # Write coordinate values to points array. if fname.endswith('.binary'): - track = open(fname, 'rb').read() - coords = [struct.unpack("ddd", track[24*i : 24*(i+1)]) - for i in range(len(track)/24)] - n_points = len(coords) - for triplet in coords: - points.InsertNextPoint(triplet) + track = open(fname, 'rb') + + # Determine number of particles and tracks/particle + n_particles = struct.unpack('i', track.read(4))[0] + n_coords = struct.unpack('i'*n_particles, track.read(4*n_particles)) + + coords = [] + for i in range(n_particles): + # Read coordinates for each particle + coords.append([struct.unpack('ddd', track.read(24)) + for j in range(n_coords[i])]) + + # Add coordinates to points data + for triplet in coords[i]: + points.InsertNextPoint(triplet) + else: - coords = h5py.File(fname).get('coordinates') - n_points = coords.shape[0] - for i in range(n_points): - points.InsertNextPoint(coords[i, :]) + track = h5py.File(fname) + n_particles = track['n_particles'].value[0] + n_coords = track['n_coords'] + coords = [] + for i in range(n_particles): + coords.append(track['coordinates_' + str(i + 1)].value) + for j in range(n_coords[i]): + points.InsertNextPoint(coords[i][j,:]) - # Create VTK line and assign points to line. - line = vtk.vtkPolyLine() - line.GetPointIds().SetNumberOfIds(n_points) - for i in range(n_points): - line.GetPointIds().SetId(i, point_offset+i) + for i in range(n_particles): + # Create VTK line and assign points to line. + line = vtk.vtkPolyLine() + line.GetPointIds().SetNumberOfIds(n_coords[i]) + for j in range(n_coords[i]): + line.GetPointIds().SetId(j, point_offset + j) + + # Add line to cell array + cells.InsertNextCell(line) + point_offset += n_coords[i] - cells.InsertNextCell(line) - point_offset += n_points data = vtk.vtkPolyData() data.SetPoints(points) data.SetLines(cells) diff --git a/src/track_output.F90 b/src/track_output.F90 index fba699e8e..9143058a2 100644 --- a/src/track_output.F90 +++ b/src/track_output.F90 @@ -12,9 +12,12 @@ module track_output implicit none - integer, private :: n_tracks ! total number of tracks - real(8), private, allocatable :: coords(:,:) ! track coordinates -!$omp threadprivate(n_tracks, coords) + type, private :: TrackCoordinates + real(8), allocatable :: coords(:,:) + end type TrackCoordinates + + type(TrackCoordinates), private, allocatable :: tracks(:) +!$omp threadprivate(tracks) contains @@ -23,7 +26,7 @@ contains !=============================================================================== subroutine initialize_particle_track() - n_tracks = 0 + allocate(tracks(1)) end subroutine initialize_particle_track !=============================================================================== @@ -32,23 +35,50 @@ contains subroutine write_particle_track(p) type(Particle), intent(in) :: p - real(8), allocatable :: new_coords(:, :) + integer :: i + integer :: n_tracks + ! Add another column to coords - n_tracks = n_tracks + 1 - if (allocated(coords)) then - allocate(new_coords(3, n_tracks)) - new_coords(:, 1:n_tracks-1) = coords - call move_alloc(FROM=new_coords, TO=coords) + i = size(tracks) + if (allocated(tracks(i) % coords)) then + n_tracks = size(tracks(i) % coords, 2) + allocate(new_coords(3, n_tracks + 1)) + new_coords(:, 1:n_tracks) = tracks(i) % coords + call move_alloc(FROM=new_coords, TO=tracks(i) % coords) else - allocate(coords(3,1)) + n_tracks = 0 + allocate(tracks(i) % coords(3, 1)) end if ! Write current coordinates into the newest column. - coords(:, n_tracks) = p % coord(1) % xyz + n_tracks = n_tracks + 1 + tracks(i) % coords(:, n_tracks) = p % coord(1) % xyz end subroutine write_particle_track +!=============================================================================== +! ADD_PARTICLE_TRACK creates a new entry in the track coordinates for a +! secondary particle +!=============================================================================== + + subroutine add_particle_track() + type(TrackCoordinates), allocatable :: new_tracks(:) + + integer :: i + + ! Determine current number of particle tracks + i = size(tracks) + + ! Create array one larger than current + allocate(new_tracks(i + 1)) + + ! Copy memory and move allocation + new_tracks(1:i) = tracks(i) + call move_alloc(FROM=new_tracks, TO=tracks) + + end subroutine add_particle_track + !=============================================================================== ! FINALIZE_PARTICLE_TRACK writes the particle track array to disk. !=============================================================================== @@ -60,6 +90,10 @@ contains character(MAX_FILE_LEN) :: fname type(BinaryOutput) :: binout + integer :: i + integer, allocatable :: n_coords(:) + integer :: n_particle_tracks + #ifdef HDF5 fname = trim(path_output) // 'track_' // trim(to_str(current_batch)) & // '_' // trim(to_str(current_gen)) // '_' // trim(to_str(p % id)) & @@ -69,13 +103,26 @@ contains // '_' // trim(to_str(current_gen)) // '_' // trim(to_str(p % id)) & // '.binary' #endif + + ! Determine total number of particles and number of coordinates for each + n_particle_tracks = size(tracks) + allocate(n_coords(n_particle_tracks)) + do i = 1, n_particle_tracks + n_coords(i) = size(tracks(i) % coords, 2) + end do + !$omp critical (FinalizeParticleTrack) call binout % file_create(fname) - length = [3, n_tracks] - call binout % write_data(coords, 'coordinates', length=length) + call binout % write_data(n_particle_tracks, 'n_particles') + call binout % write_data(n_coords, 'n_coords', length=n_particle_tracks) + do i = 1, n_particle_tracks + length(:) = [3, n_coords(i)] + call binout % write_data(tracks(i) % coords, 'coordinates_' // & + trim(to_str(i)), length=length) + end do call binout % file_close() !$omp end critical (FinalizeParticleTrack) - deallocate(coords) + deallocate(tracks) end subroutine finalize_particle_track end module track_output diff --git a/src/tracking.F90 b/src/tracking.F90 index ba452a014..173babd2f 100644 --- a/src/tracking.F90 +++ b/src/tracking.F90 @@ -15,7 +15,7 @@ module tracking use tally, only: score_analog_tally, score_tracklength_tally, & score_surface_current use track_output, only: initialize_particle_track, write_particle_track, & - finalize_particle_track + add_particle_track, finalize_particle_track implicit none @@ -200,6 +200,9 @@ contains if (p % n_secondary > 0) then call p % initialize_from_source(p % secondary_bank(p % n_secondary)) p % n_secondary = p % n_secondary - 1 + + ! Enter new particle in particle track file + if (p % write_track) call add_particle_track() else exit EVENT_LOOP end if From 56525c01d13859aaa42d107f1f9e56b0e9b7a3fc Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Fri, 21 Aug 2015 11:02:05 +0700 Subject: [PATCH 36/43] Add comments describing a number of procedures --- src/eigenvalue.F90 | 4 +++- src/particle_header.F90 | 11 +++++++---- src/source.F90 | 3 ++- src/track_output.F90 | 3 ++- 4 files changed, 14 insertions(+), 7 deletions(-) diff --git a/src/eigenvalue.F90 b/src/eigenvalue.F90 index 6a4591705..33d63b7cc 100644 --- a/src/eigenvalue.F90 +++ b/src/eigenvalue.F90 @@ -583,7 +583,9 @@ contains #ifdef _OPENMP !=============================================================================== -! JOIN_BANK_FROM_THREADS +! JOIN_BANK_FROM_THREADS joins threadprivate fission banks into a single fission +! bank that can be sampled. Note that this operation is necessarily sequential +! to preserve the order of the bank when using varying numbers of threads. !=============================================================================== subroutine join_bank_from_threads() diff --git a/src/particle_header.F90 b/src/particle_header.F90 index 9164845e8..cf3bb5efa 100644 --- a/src/particle_header.F90 +++ b/src/particle_header.F90 @@ -129,7 +129,7 @@ contains end subroutine initialize_particle !=============================================================================== -! CLEAR_PARTICLE +! CLEAR_PARTICLE resets all coordinate levels for the particle !=============================================================================== subroutine clear_particle(this) @@ -145,7 +145,7 @@ contains end subroutine clear_particle !=============================================================================== -! RESET_COORD +! RESET_COORD clears data from a single coordinate level !=============================================================================== elemental subroutine reset_coord(this) @@ -162,7 +162,9 @@ contains end subroutine reset_coord !=============================================================================== -! INITIALIZE_FROM_SOURCE +! INITIALIZE_FROM_SOURCE initializes a particle from data stored in a source +! site. The source site may have been produced from an external source, from +! fission, or simply as a secondary particle. !=============================================================================== subroutine initialize_from_source(this, src) @@ -185,7 +187,8 @@ contains end subroutine initialize_from_source !=============================================================================== -! CREATE_SECONDARY +! CREATE_SECONDARY stores the current phase space attributes of the particle in +! the secondary bank and increments the number of sites in the secondary bank. !=============================================================================== subroutine create_secondary(this, uvw, type) diff --git a/src/source.F90 b/src/source.F90 index 32be6069c..e82482915 100644 --- a/src/source.F90 +++ b/src/source.F90 @@ -92,7 +92,8 @@ contains end subroutine initialize_source !=============================================================================== -! SAMPLE_EXTERNAL_SOURCE +! SAMPLE_EXTERNAL_SOURCE samples the user-specified external source and stores +! the position, angle, and energy in a Bank type. !=============================================================================== subroutine sample_external_source(site) diff --git a/src/track_output.F90 b/src/track_output.F90 index 9143058a2..6ab514cdb 100644 --- a/src/track_output.F90 +++ b/src/track_output.F90 @@ -22,7 +22,8 @@ module track_output contains !=============================================================================== -! INITIALIZE_PARTICLE_TRACK +! INITIALIZE_PARTICLE_TRACK allocates the array to store particle track +! information !=============================================================================== subroutine initialize_particle_track() From 621601bf90c97538bd149b1efaab8bbbe9f5fe67 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Tue, 25 Aug 2015 16:42:39 +0700 Subject: [PATCH 37/43] Fix typo in comment --- src/simulation.F90 | 5 +++-- 1 file changed, 3 insertions(+), 2 deletions(-) diff --git a/src/simulation.F90 b/src/simulation.F90 index ab9b42248..cc230d645 100644 --- a/src/simulation.F90 +++ b/src/simulation.F90 @@ -32,8 +32,9 @@ module simulation contains !=============================================================================== -! RUN_EIGENVALUE encompasses all the main logic where iterations are performed -! over the batches, generations, and histories in a k-eigenvalue calculation. +! RUN_SIMULATION encompasses all the main logic where iterations are performed +! over the batches, generations, and histories in a fixed source or k-eigenvalue +! calculation. !=============================================================================== subroutine run_simulation() From 48f5de2b41b334db2c1ce0dd930ef6e29bd1f2de Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Tue, 25 Aug 2015 16:42:56 +0700 Subject: [PATCH 38/43] Check to make sure limit on secondary particles is not exceeded --- src/particle_header.F90 | 7 +++++++ 1 file changed, 7 insertions(+) diff --git a/src/particle_header.F90 b/src/particle_header.F90 index cf3bb5efa..66df6b6e5 100644 --- a/src/particle_header.F90 +++ b/src/particle_header.F90 @@ -2,6 +2,7 @@ module particle_header use bank_header, only: Bank use constants, only: NEUTRON, ONE, NONE, ZERO, MAX_SECONDARY + use error, only: fatal_error use geometry_header, only: BASE_UNIVERSE implicit none @@ -198,6 +199,12 @@ contains integer :: n + ! Check to make sure that the hard-limit on secondary particles is not + ! exceeded. + if (this % n_secondary == MAX_SECONDARY) then + call fatal_error("Too many secondary particles created.") + end if + n = this % n_secondary + 1 this % secondary_bank(n) % wgt = this % wgt this % secondary_bank(n) % xyz(:) = this % coord(1) % xyz From c922f35bdcf55433700149cfbf2a919da135bdcd Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Wed, 26 Aug 2015 10:02:56 +0700 Subject: [PATCH 39/43] Fix typo in initialize module --- src/initialize.F90 | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/initialize.F90 b/src/initialize.F90 index fd63963bf..b944b6677 100644 --- a/src/initialize.F90 +++ b/src/initialize.F90 @@ -140,7 +140,7 @@ contains ! Determine how much work each processor should do call calculate_work() - ! Allocate source bank, and for eigenvalu simulations also allocate the + ! Allocate source bank, and for eigenvalue simulations also allocate the ! fission bank call allocate_banks() From af442677c015fcf48263fde46b402e665585d71d Mon Sep 17 00:00:00 2001 From: Will Boyd Date: Wed, 2 Sep 2015 19:50:56 -0700 Subject: [PATCH 40/43] Changed Tally.get_value to Tally.get_values in Python scripts --- scripts/openmc-plot-mesh-tally | 4 ++-- scripts/openmc-statepoint-3d | 2 +- 2 files changed, 3 insertions(+), 3 deletions(-) diff --git a/scripts/openmc-plot-mesh-tally b/scripts/openmc-plot-mesh-tally index 5c46d927c..d49c9061d 100755 --- a/scripts/openmc-plot-mesh-tally +++ b/scripts/openmc-plot-mesh-tally @@ -230,9 +230,9 @@ class MeshPlotter(tk.Frame): meshtuple = (i + 1, axial_level, j + 1) filters, filter_bins = zip(*spec_list + [ (mesh_filter, meshtuple)]) - mean = selectedTally.get_value( + mean = selectedTally.get_values( self.scoreBox.get(), filters, filter_bins) - stdev = selectedTally.get_value( + stdev = selectedTally.get_values( self.scoreBox.get(), filters, filter_bins, value='std_dev') if mbvalue == 'Mean': diff --git a/scripts/openmc-statepoint-3d b/scripts/openmc-statepoint-3d index 30205c769..e667ad0bb 100755 --- a/scripts/openmc-statepoint-3d +++ b/scripts/openmc-statepoint-3d @@ -219,7 +219,7 @@ def main(file_, o): for y in range(1,ny+1): for z in range(1,nz+1): filterspec[0][1] = (x,y,z) - val = sp.get_value(tally.id-1, filterspec, sid)[o.valerr] + val = sp.get_values(tally.id-1, filterspec, sid)[o.valerr] if o.vtk: # vtk cells go z, y, x, so we store it now and enter it later i = (z-1)*nx*ny + (y-1)*nx + x-1 From cfd79626bcfa490e02715451a8309e809497e484 Mon Sep 17 00:00:00 2001 From: Paul Romano Date: Thu, 3 Sep 2015 15:58:33 +0700 Subject: [PATCH 41/43] Fix arguments to Tally.get_values(...) in openmc-plot-mesh-tally --- scripts/openmc-plot-mesh-tally | 8 ++++---- 1 file changed, 4 insertions(+), 4 deletions(-) diff --git a/scripts/openmc-plot-mesh-tally b/scripts/openmc-plot-mesh-tally index d49c9061d..d9bca6377 100755 --- a/scripts/openmc-plot-mesh-tally +++ b/scripts/openmc-plot-mesh-tally @@ -210,7 +210,7 @@ class MeshPlotter(tk.Frame): mesh_filter = f continue index = self.filterBoxes[f.type].current() - spec_list.append((f, index)) + spec_list.append((f.type, (index,))) text = self.basisBox.get() if text == 'xy': @@ -229,11 +229,11 @@ class MeshPlotter(tk.Frame): else: meshtuple = (i + 1, axial_level, j + 1) filters, filter_bins = zip(*spec_list + [ - (mesh_filter, meshtuple)]) + (mesh_filter.type, (meshtuple,))]) mean = selectedTally.get_values( - self.scoreBox.get(), filters, filter_bins) + [self.scoreBox.get()], filters, filter_bins) stdev = selectedTally.get_values( - self.scoreBox.get(), filters, filter_bins, + [self.scoreBox.get()], filters, filter_bins, value='std_dev') if mbvalue == 'Mean': matrix[i, j] = mean From 53edae4c7e8824b4a3a5dbd03f48a01b9dbeb08b Mon Sep 17 00:00:00 2001 From: Will Boyd Date: Thu, 3 Sep 2015 07:31:33 -0700 Subject: [PATCH 42/43] Updated openmc-plot-mesh-tally to include if-else for 2D vs. 3D meshes --- scripts/openmc-plot-mesh-tally | 6 +++++- 1 file changed, 5 insertions(+), 1 deletion(-) diff --git a/scripts/openmc-plot-mesh-tally b/scripts/openmc-plot-mesh-tally index d9bca6377..f925b413a 100755 --- a/scripts/openmc-plot-mesh-tally +++ b/scripts/openmc-plot-mesh-tally @@ -133,7 +133,11 @@ class MeshPlotter(tk.Frame): self.mesh = selectedTally.filters_by_name['mesh'].mesh # Get mesh dimensions - self.nx, self.ny, self.nz = self.mesh.dimension + if len(self.mesh.dimension) == 2: + self.nx, self.ny = self.mesh.dimension + self.nz = 1 + else: + self.nx, self.ny, self.nz = self.mesh.dimension # Repopulate comboboxes baesd on current basis selection text = self.basisBox.get() From 4aec0454a8b6f9c68e8737a8b27ecf2b94ef65c6 Mon Sep 17 00:00:00 2001 From: Will Boyd Date: Thu, 3 Sep 2015 07:33:33 -0700 Subject: [PATCH 43/43] Updated docstring for Tally.get_values(...) with correct use of Iterable filter bins --- openmc/tallies.py | 12 ++++++------ 1 file changed, 6 insertions(+), 6 deletions(-) diff --git a/openmc/tallies.py b/openmc/tallies.py index 6e418a2be..003acd943 100644 --- a/openmc/tallies.py +++ b/openmc/tallies.py @@ -823,10 +823,10 @@ class Tally(object): A list of filter type strings (e.g., ['mesh', 'energy']; default is []) - filter_bins : list + filter_bins : list of Iterables A list of the filter bins corresponding to the filter_types - parameter (e.g., [1, (0., 0.625e-6)]; default is []). Each bin in - the list is the integer ID for 'material', 'surface', 'cell', + parameter (e.g., [(1,), (0., 0.625e-6)]; default is []). Each bin + in the list is the integer ID for 'material', 'surface', 'cell', 'cellborn', and 'universe' Filters. Each bin is an integer for the cell instance ID for 'distribcell Filters. Each bin is a 2-tuple of floats for 'energy' and 'energyout' filters corresponding to the @@ -2099,10 +2099,10 @@ class Tally(object): A list of filter type strings (e.g., ['mesh', 'energy']; default is []) - filter_bins : list + filter_bins : list of Iterables A list of the filter bins corresponding to the filter_types - parameter (e.g., [1, (0., 0.625e-6)]; default is []). Each bin in - the list is the integer ID for 'material', 'surface', 'cell', + parameter (e.g., [(1,), (0., 0.625e-6)]; default is []). Each bin + in the list is the integer ID for 'material', 'surface', 'cell', 'cellborn', and 'universe' Filters. Each bin is an integer for the cell instance ID for 'distribcell Filters. Each bin is a 2-tuple of floats for 'energy' and 'energyout' filters corresponding to the