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Makefile
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changes in the name of path_int --> path_interpolation
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2011-01-27 12:09:40 +00:00 |
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compute_scf.f90
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no parallel with images is working. still inconsistencies with stdout (out.0_0)
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2011-01-27 10:15:44 +00:00 |
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engine_to_path_alat.f90
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neb working with the input parser. ONLY SERIAL AT THE MOMENT!!!!!!
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2011-01-17 17:05:02 +00:00 |
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engine_to_path_fix_atom_pos.f90
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neb working with the input parser. ONLY SERIAL AT THE MOMENT!!!!!!
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2011-01-17 17:05:02 +00:00 |
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engine_to_path_nat.f90
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neb working with the input parser. ONLY SERIAL AT THE MOMENT!!!!!!
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2011-01-17 17:05:02 +00:00 |
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engine_to_path_pos.f90
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neb working with the input parser. ONLY SERIAL AT THE MOMENT!!!!!!
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2011-01-17 17:05:02 +00:00 |
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input.f90
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change ionode to meta_ionode in neb_verify_tmpdir. Problems with close
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2011-01-27 10:37:03 +00:00 |
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io_tools.f90
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added research of argument -input_images when not parsing input file
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2011-02-01 10:44:58 +00:00 |
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make.depend
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change ionode to meta_ionode in neb_verify_tmpdir. Problems with close
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2011-01-27 10:37:03 +00:00 |
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path_base.f90
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no parallel with images is working. still inconsistencies with stdout (out.0_0)
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2011-01-27 10:15:44 +00:00 |
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path_formats.f90
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add neb files to NEB dir (all from original path files)
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2010-08-30 12:11:47 +00:00 |
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path_gen_inputs.f90
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added starting_wfc and starting_pot to compute_scf, parall stuff for
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2011-01-18 11:36:50 +00:00 |
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path_input_parameters_module.f90
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neb working with the input parser. ONLY SERIAL AT THE MOMENT!!!!!!
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2011-01-17 17:05:02 +00:00 |
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path_interpolation.f90
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changes in the name of path_int --> path_interpolation
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2011-01-27 12:09:40 +00:00 |
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path_interpolation.sh
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changes in the name of path_int --> path_interpolation
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2011-01-27 12:09:40 +00:00 |
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path_io_routines.f90
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no parallel with images is working. still inconsistencies with stdout (out.0_0)
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2011-01-27 10:15:44 +00:00 |
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path_io_units_module.f90
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added io files for neb.
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2010-12-20 22:18:50 +00:00 |
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path_merge.sh
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path related routines in pwtools moved to NEB dir
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2010-08-31 03:22:54 +00:00 |
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path_opt_routines.f90
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more cleaning in neb. preparing thinks for introducing the input parser.
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2011-01-10 17:13:35 +00:00 |
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path_read_cards_module.f90
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neb working with the input parser. ONLY SERIAL AT THE MOMENT!!!!!!
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2011-01-17 17:05:02 +00:00 |
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path_read_namelists_module.f90
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more cleaning in neb. preparing thinks for introducing the input parser.
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2011-01-10 17:13:35 +00:00 |
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path_reparametrisation.f90
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a lot of cleaning for neb. parallelism on pw is working. parall
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2010-12-20 22:17:20 +00:00 |
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path_to_engine_fix_atom_pos.f90
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neb working with the input parser. ONLY SERIAL AT THE MOMENT!!!!!!
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2011-01-17 17:05:02 +00:00 |
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path_to_engine_mp.f90
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missing file path_to_engine_mp
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2011-01-27 10:54:22 +00:00 |
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path_variables.f90
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more cleaning in neb. preparing thinks for introducing the input parser.
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2011-01-10 17:13:35 +00:00 |
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set_defaults.f90
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neb working with the input parser. ONLY SERIAL AT THE MOMENT!!!!!!
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2011-01-17 17:05:02 +00:00 |
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stop_run_path.f90
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no parallel with images is working. still inconsistencies with stdout (out.0_0)
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2011-01-27 10:15:44 +00:00 |
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string_methods.f90
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change if(lfound_input_images==.false.) with if(.not. ...). Working
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2011-02-01 11:11:54 +00:00 |
a44fb883bf