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Update for 2009

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svn-origin-rev: 8096
This commit is contained in:
Teodoro Laino 2008-12-31 11:16:41 +00:00
parent 39d24ab3ce
commit a07cd8d75c
687 changed files with 692 additions and 686 deletions
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2
COPYRIGHT
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! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000, 2001, 2002, 2003 CP2K developers group !
! Copyright (C) 2004, 2005, 2006, 2007 CP2K developers group !
! Copyright (C) 2008 CP2K developers group !
! Copyright (C) 2008, 2009 CP2K developers group !
! !
! This program is free software; you can redistribute it and/or modify !
! it under the terms of the GNU General Public License as published by !

2
src/_el_typename__list_types.template
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/ai_angmom.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/ai_coulomb.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/ai_derivatives.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/ai_kinetic.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/ai_moments.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/ai_onecenter.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
!
!-----------------------------------------------------------------------------!

2
src/ai_overlap_new.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/ai_overlap_ppl.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/ai_verfc.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atom.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atom_electronic_structure.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atom_fit.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atom_operators.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atom_optimization.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atom_output.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atom_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atom_utils.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atom_xc.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atomic_charges.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atomic_kind_list_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atomic_kind_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/atoms_input.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/averages_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/barostat_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/barostat_utils.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/basis_set_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/bessel_lib.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/beta_gamma_psi.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/bfgs_optimizer.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/bibliography.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2007 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/block_p_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/bsse.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cell_opt.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cell_opt_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cell_opt_utils.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cell_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cg_optimizer.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cg_test.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cg_utils.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/colvar_methods.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/colvar_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/colvar_utils.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2007 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/constraint.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/constraint_3x3.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/constraint_4x6.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/constraint_clv.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/constraint_fxd.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/constraint_util.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/constraint_vsite.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/core_ppnl.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************
!> \brief Calculation of the non-local pseudopotential contribution to the core Hamiltonian

2
src/cp2k.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp2k_debug.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp2k_info.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp2k_runs.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp2k_shell.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp__el_name__pool_types.template
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_array__nametype1__utils.template
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
[defines]

2
src/cp_array_i_utils.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
#define CP_I_LESS_Q(el1,el2) ( el1 < el2 )

2
src/cp_array_logical_utils.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
#define CP_L_LESS_Q(el1,el2) ( (.not.el1).and.el2 )

2
src/cp_array_r_utils.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
#define CP_R_LESS_Q(el1,el2) ( el1 < el2 )

2
src/cp_array_utils.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_blacs_calls.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_blacs_env.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_cfm_basic_linalg.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_cfm_diag.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_cfm_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_control_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_control_utils.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_ddapc.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_ddapc_forces.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_ddapc_methods.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_ddapc_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_ddapc_util.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_error_handling.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_files.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_fm_basic_linalg.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_fm_cholesky.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_fm_diag.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_fm_pool_types.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_fm_struct.F
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!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_fm_types.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_fm_vect.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_iter_types.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_lbfgs_geo.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_lbfgs_optimizer__nametype1_.template
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_lbfgs_optimizer_gopt.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! *****************************************************************************

2
src/cp_linked_list_3d_r.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! less not much meningful... and defines oly a partial ordering.

2
src/cp_linked_list__nametype1_.template
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
[defines]

2
src/cp_linked_list_char.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
#define CP_SLL_C_LESS_Q(el1,el2,error) ( el1 < el2 )

2
src/cp_linked_list_fm.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! less not much meningful...

2
src/cp_linked_list_int.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
#define CP_SLL_I_LESS_Q(el1,el2,error) ( el1 < el2 )

2
src/cp_linked_list_logical.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
#define CP_SLL_L_LESS_Q(el1,el2,error) ( .not.el1.and.el2 )

2
src/cp_linked_list_pw.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! less not much meaningful...

2
src/cp_linked_list_real.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
#define CP_SLL_R_LESS_Q(el1,el2,error) ( el1 < el2 )

2
src/cp_linked_list_rs.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! less not much meningful...

2
src/cp_linked_list_sm.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
! less not much meningful...

2
src/cp_linked_list_val.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
#define CP_SLL_VAL_LESS_Q(el1,el2,error) el1%id_nr<el2%id_nr

2
src/cp_linked_list_xc_deriv.F
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@ -1,6 +1,6 @@
!-----------------------------------------------------------------------------!
! CP2K: A general program to perform molecular dynamics simulations !
! Copyright (C) 2000 - 2008 CP2K developers group !
! Copyright (C) 2000 - 2009 CP2K developers group !
!-----------------------------------------------------------------------------!
#define CP_SLL_DERIV_LESS_Q(el1,el2,error) cp_sll_deriv_less_q(el1,el2,error)

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