#!/bin/bash BASE_DIR=/opt/ ##### DOWNLOAD DATA ##### mkdir -p $BASE_DIR/xdata && cd $BASE_DIR/xdata wget -c -O endfb71.tar.xz https://anl.box.com/shared/static/9igk353zpy8fn9ttvtrqgzvw1vtejoz6.xz tar -xf endfb71.tar.xz wget -c -O endfb80.tar.xz https://anl.box.com/shared/static/uhbxlrx7hvxqw27psymfbhi7bx7s6u6a.xz tar -xf endfb80.tar.xz wget -c -O jeff33.tar.xz https://anl.box.com/shared/static/4jwkvrr9pxlruuihcrgti75zde6g7bum.xz tar -xf jeff33.tar.xz wget -c -O lib80x.tar.xz https://anl.box.com/shared/static/nd7p4jherolkx4b1rfaw5uqp58nxtstr.xz tar -xf lib80x.tar.xz wget -c -O fendl32.tar.xz https://anl.box.com/shared/static/3cb7jetw7tmxaw6nvn77x6c578jnm2ey.xz tar -xf fendl32.tar.xz wget -c -O endfb-vii.1-hdf5/chain_endfb71_pwr.xml https://anl.box.com/shared/static/os1u896bwsbopurpgas72bi6aij2zzdc.xml wget -c -O endfb-vii.1-hdf5/chain_endfb71_sfr.xml https://anl.box.com/shared/static/9058zje1gm0ekd93hja542su50pccvj0.xml wget -c -O endfb-viii.0-hdf5/chain_endfb80_pwr.xml https://anl.box.com/shared/static/nyezmyuofd4eqt6wzd626lqth7wvpprr.xml wget -c -O endfb-viii.0-hdf5/chain_endfb80_sfr.xml https://anl.box.com/shared/static/x3kp739hr5upmeqpbwx9zk9ep04fnmtg.xml mkdir casl_deplete wget -c -O casl_deplete/chain_casl_pwr.xml https://anl.box.com/shared/static/3nvnasacm2b56716oh5hyndxdyauh5gs.xml wget -c -O casl_deplete/chain_casl_sfr.xml https://anl.box.com/shared/static/9fqbq87j0tx4m6vfl06pl4ccc0hwamg9.xml ######################### module load gcc/10.2.0 module load openmpi/4.1.4 module load python/miniconda23.5.2 source /share/apps/python/miniconda23.5.2/etc/profile.d/conda.sh conda info --envs conda create -n openmc-env conda activate openmc-env conda install -c conda-forge openmc (nodagmc_nompi_py311h86d942f_0) conda list conda search openmc conda search openmc --channel conda-forge echo $OPENMC_CROSS_SECTIONS python --version ## ADD %env OPENMC_CROSS_SECTIONS /opt/xdata/endfb-vii.1-hdf5/cross_sections.xml ## to the top of any Notebook files you use openmc -g -n 1000000 -s 32 -t -e problem ########## INSTALL OPENMC FROM SOURCE ################ ## Dependencies ## ## OpenMC # sudo apt install g++ cmake libhdf5-dev libpng-dev (mpich libmpich-dev) openmpi-bin libopenmpi-dev git ## DagMC # sudo apt install libeigen3-dev libhdf5-dev # cd $HOME/dagmc_bld # mkdir DAGMC # cd DAGMC # git clone https://github.com/svalinn/DAGMC # cd DAGMC # git checkout develop # git submodule update --init # cd $HOME/dagmc_bld/DAGMC # ln -s DAGMC src # mkdir bld # cd bld # INSTALL_PATH=$HOME/dagmc_bld/DAGMC # cmake ../src -DMOAB_DIR=$HOME/dagmc_bld/MOAB \ # -DBUILD_TALLY=ON \ # -DCMAKE_INSTALL_PREFIX=$INSTALL_PATH # make # make install # export LD_LIBRARY_PATH=$LD_LIBRARY_PATH:$HOME/dagmc_bld/dagmc/lib ## HDF5 # cd ${BASE_DIR} # wget -c https://support.hdfgroup.org/ftp/HDF5/releases/hdf5-1.8/hdf5-1.8.13/src/hdf5-1.8.13.tar.gz # tar -xzvf hdf5-1.8.13.tar.gz # cd hdf5-1.8.13 # mkdir build && cd build # CC=${MPI_ROOT}/bin/mpicc ../configure --enable-shared \ # --enable-parallel \ # --prefix=${HDF5_DIR} # ${MAKE} -j16 # ${MAKE} -j16 check # ${MAKE} -j16 install ## MOAB # cd $HOME/dagmc_bld # mkdir -p MOAB/bld # cd MOAB # git clone https://bitbucket.org/fathomteam/moab # cd moab # git checkout Version5.1.0 # autoreconf -fi # cd .. # ln -s moab src # cd bld # ../src/configure --enable-optimize \ # --enable-shared \ # --disable-debug \ # --with-hdf5=$HOME/dagmc_bld/HDF5 \ # --prefix=$HOME/dagmc_bld/MOAB # make # make check # make install # export PATH=$PATH:$HOME/dagmc_bld/HDF5/bin # export PATH=$PATH:$HOME/dagmc_bld/MOAB/bin # export LD_LIBRARY_PATH=$LD_LIBRARY_PATH:$HOME/dagmc_bld/HDF5/lib # export LD_LIBRARY_PATH=$LD_LIBRARY_PATH:$HOME/dagmc_bld/MOAB/lib # which h5ls # which mbconvert module load gcc/8.1.0 openmpi/4.1.4 cmake/3.26.3 git/2.42.0 python/3.11.5 git clone --recurse-submodules https://github.com/openmc-dev/openmc.git cd openmc git checkout v0.13.3 mkdir build && cd build HDF5_ROOT=/share/apps/hdf5-withmpi/gcc/8.1.0/openmpi/4.1.4 \ cmake .. -DOPENMC_USE_OPENMP=on -DOPENMC_USE_MPI=on -DHDF5_PREFER_PARALLEL=on \ -DCMAKE_BUILD_TYPE=Release -DCMAKE_INSTALL_PREFIX=$HOME/openmc make -j24 make -j24 install cd .. MPICC=${MPI_ROOT}/bin/mpicc pip3 install mpi4py CC=/share/apps/openmpi/4.1.4/gcc/8.1.0/bin/mpicc HDF5_MPI=ON \ HDF5_DIR=/share/apps/hdf5-withmpi/gcc/8.1.0/openmpi/4.1.4 \ pip3 install --no-binary=h5py h5py PATH=${HOME}/openmc/bin:${PATH} PATH=${PATH}/.local/bin:${PATH} export PATH pip3 install .