Searched refs:sub_atom_index (Results 1 – 8 of 8) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | cp_subsys_methods.F | 269 small_para_env, sub_atom_index, sub_atom_kind_name, & argument 275 INTEGER, DIMENSION(:), INTENT(in) :: sub_atom_index local 322 nat = SIZE(sub_atom_index) 337 topology%atom_info%r(:, iat) = particles%els(sub_atom_index(iat))%r
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H A D | mscfg_methods.F | 286 … small_para_env=para_env, small_cell=cell, sub_atom_index=atom_index, &
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H A D | qmmm_create.F | 346 small_cell=qm_cell_small, sub_atom_index=qm_atom_index, &
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H A D | bsse.F | 320 … small_para_env=para_env, small_cell=cell, sub_atom_index=atom_index, &
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | cp_subsys_methods.F | 269 small_para_env, sub_atom_index, sub_atom_kind_name, & argument 275 INTEGER, DIMENSION(:), INTENT(in) :: sub_atom_index local 322 nat = SIZE(sub_atom_index) 337 topology%atom_info%r(:, iat) = particles%els(sub_atom_index(iat))%r
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H A D | mscfg_methods.F | 286 … small_para_env=para_env, small_cell=cell, sub_atom_index=atom_index, &
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H A D | qmmm_create.F | 346 small_cell=qm_cell_small, sub_atom_index=qm_atom_index, &
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H A D | bsse.F | 320 … small_para_env=para_env, small_cell=cell, sub_atom_index=atom_index, &
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