Searched refs:natoms_bulk (Results 1 – 4 of 4) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | negf_vectors.F | 50 INTEGER :: handle, iatom, natoms_bulk, & local 60 natoms_bulk = SIZE(atomlist_bulk) 64 CPASSERT(natoms_bulk > 0) 76 DO iatom = 2, natoms_bulk 79 direction_vector = direction_vector/REAL(natoms_bulk, kind=dp)
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H A D | negf_env_types.F | 1100 natoms_bulk, natoms_cell0 local 1108 natoms_bulk = SIZE(atomlist_bulk) 1109 CPASSERT(SIZE(atom_map, 1) == natoms_bulk) 1115 DO iatom = 1, natoms_bulk 1128 DO iatom = 1, natoms_bulk 1137 DO iatom = 1, natoms_bulk 1189 natoms_bulk = SIZE(atomlist_bulk) 1190 CPASSERT(SIZE(atom_map, 1) == natoms_bulk) 1197 DO iatom = 1, natoms_bulk 1210 DO iatom = 1, natoms_bulk [all …]
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | negf_vectors.F | 50 INTEGER :: handle, iatom, natoms_bulk, & local 60 natoms_bulk = SIZE(atomlist_bulk) 64 CPASSERT(natoms_bulk > 0) 76 DO iatom = 2, natoms_bulk 79 direction_vector = direction_vector/REAL(natoms_bulk, kind=dp)
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H A D | negf_env_types.F | 1100 natoms_bulk, natoms_cell0 local 1108 natoms_bulk = SIZE(atomlist_bulk) 1109 CPASSERT(SIZE(atom_map, 1) == natoms_bulk) 1115 DO iatom = 1, natoms_bulk 1128 DO iatom = 1, natoms_bulk 1137 DO iatom = 1, natoms_bulk 1189 natoms_bulk = SIZE(atomlist_bulk) 1190 CPASSERT(SIZE(atom_map, 1) == natoms_bulk) 1197 DO iatom = 1, natoms_bulk 1210 DO iatom = 1, natoms_bulk [all …]
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