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Searched refs:list_local_a_index (Results 1 – 4 of 4) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dfist_neighbor_lists.F166 NULLIFY (atom(ikind)%list_local_a_index)
177 ALLOCATE (atom(ikind)%list_local_a_index(natom_local_a))
185 atom(ikind)%list_local_a_index(iatom_local) = atom_a
231 IF (ASSOCIATED(atom(ikind)%list_local_a_index)) THEN
232 DEALLOCATE (atom(ikind)%list_local_a_index)
420 IF (.NOT. ASSOCIATED(atom(ikind)%list_local_a_index)) CYCLE
421 natom_local_a = SIZE(atom(ikind)%list_local_a_index)
423 atom_a = atom(ikind)%list_local_a_index(iatom_local)
437 IF (.NOT. ASSOCIATED(atom(ikind)%list_local_a_index)) CYCLE
438 natom_local_a = SIZE(atom(ikind)%list_local_a_index)
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H A Dqs_neighbor_lists.F104 list_local_a_index, & component
138 IF (ASSOCIATED(atom2d(ikind)%list_local_a_index)) THEN
139 DEALLOCATE (atom2d(ikind)%list_local_a_index)
208 NULLIFY (atom2d(ikind)%list_local_a_index)
235 ALLOCATE (atom2d(ikind)%list_local_a_index(natom_local_a))
243 atom2d(ikind)%list_local_a_index(iatom_local) = listindex(iatom)
1095 IF (ASSOCIATED(atom(ikind)%list_local_a_index)) THEN
1096 lista(ikind)%list => atom(ikind)%list_local_a_index
1104 IF (ASSOCIATED(atom(ikind)%list_local_a_index)) THEN
1105 lista(ikind)%list => atom(ikind)%list_local_a_index
[all …]
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dfist_neighbor_lists.F166 NULLIFY (atom(ikind)%list_local_a_index)
177 ALLOCATE (atom(ikind)%list_local_a_index(natom_local_a))
185 atom(ikind)%list_local_a_index(iatom_local) = atom_a
231 IF (ASSOCIATED(atom(ikind)%list_local_a_index)) THEN
232 DEALLOCATE (atom(ikind)%list_local_a_index)
420 IF (.NOT. ASSOCIATED(atom(ikind)%list_local_a_index)) CYCLE
421 natom_local_a = SIZE(atom(ikind)%list_local_a_index)
423 atom_a = atom(ikind)%list_local_a_index(iatom_local)
437 IF (.NOT. ASSOCIATED(atom(ikind)%list_local_a_index)) CYCLE
438 natom_local_a = SIZE(atom(ikind)%list_local_a_index)
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H A Dqs_neighbor_lists.F105 list_local_a_index, & component
139 IF (ASSOCIATED(atom2d(ikind)%list_local_a_index)) THEN
140 DEALLOCATE (atom2d(ikind)%list_local_a_index)
209 NULLIFY (atom2d(ikind)%list_local_a_index)
236 ALLOCATE (atom2d(ikind)%list_local_a_index(natom_local_a))
244 atom2d(ikind)%list_local_a_index(iatom_local) = listindex(iatom)
1095 IF (ASSOCIATED(atom(ikind)%list_local_a_index)) THEN
1096 lista(ikind)%list => atom(ikind)%list_local_a_index
1104 IF (ASSOCIATED(atom(ikind)%list_local_a_index)) THEN
1105 lista(ikind)%list => atom(ikind)%list_local_a_index
[all …]