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Searched refs:mm_indexes (Results 1 – 2 of 2) sorted by relevance

/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dqmmm_init.F1044 i_vals=mm_indexes)
1045 num_qm_atom_tot = num_qm_atom_tot + SIZE(mm_indexes)
1088 i_vals=mm_indexes)
1090 qm_atom_index(num_qm_atom_tot:num_qm_atom_tot + SIZE(mm_indexes) - 1) = mm_indexes(:)
1097 num_qm_atom_tot = num_qm_atom_tot + SIZE(mm_indexes)
1511 NULLIFY (mm_indexes, molecule_kind)
1520 i_rep_val=i, i_vals=mm_indexes)
1521 num_image_mm_atom = num_image_mm_atom + SIZE(mm_indexes)
1531 i_rep_val=i, i_vals=mm_indexes)
1533 + SIZE(mm_indexes) - 1) = mm_indexes(:)
[all …]
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dqmmm_init.F1044 i_vals=mm_indexes)
1045 num_qm_atom_tot = num_qm_atom_tot + SIZE(mm_indexes)
1088 i_vals=mm_indexes)
1090 qm_atom_index(num_qm_atom_tot:num_qm_atom_tot + SIZE(mm_indexes) - 1) = mm_indexes(:)
1097 num_qm_atom_tot = num_qm_atom_tot + SIZE(mm_indexes)
1511 NULLIFY (mm_indexes, molecule_kind)
1520 i_rep_val=i, i_vals=mm_indexes)
1521 num_image_mm_atom = num_image_mm_atom + SIZE(mm_indexes)
1531 i_rep_val=i, i_vals=mm_indexes)
1533 + SIZE(mm_indexes) - 1) = mm_indexes(:)
[all …]