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Searched refs:latom_block (Results 1 – 6 of 6) sorted by relevance

/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dhfx_load_balance_methods.F480 IF (latom_block < katom_block) CYCLE
493 latom_start = x_data%blocks(latom_block)%istart
494 latom_end = x_data%blocks(latom_block)%iend
574 IF (latom_block < katom_block) CYCLE
594 latom_end = x_data%blocks(latom_block)%iend
1029 IF (latom_block < katom_block) CYCLE
1039 latom_end = x_data%blocks(latom_block)%iend
1275 IF (latom_block < katom_block) CYCLE
1293 col = (iatom_block - 1)*nblocks + latom_block
1310 latom_start = x_data%blocks(latom_block)%istart
[all …]
H A Dhfx_derivatives.F132 INTEGER :: kind_kind_idx, kkind, kset, l_atom, l_max, latom, latom_block, latom_end, & local
904 latom_block = INT(MODULO(atom_block, nblocks)) + 1
907 IF (latom_block < katom_block) CYCLE
922 latom_start = actual_x_data%blocks(latom_block)%istart
923 latom_end = actual_x_data%blocks(latom_block)%iend
926 shm_pmax_block(latom_block, jatom_block), &
927 shm_pmax_block(latom_block, iatom_block) + &
H A Dhfx_energy_potential.F162 INTEGER :: katom_start, kind_kind_idx, kkind, kset, l_max, latom, latom_block, latom_end, & local
1135 latom_block = INT(MODULO(atom_block, nblocks)) + 1
1138 IF (latom_block < katom_block) CYCLE
1153 latom_start = actual_x_data%blocks(latom_block)%istart
1154 latom_end = actual_x_data%blocks(latom_block)%iend
1157 shm_pmax_block(latom_block, jatom_block), &
1158 shm_pmax_block(latom_block, iatom_block), &
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dhfx_load_balance_methods.F477 IF (latom_block < katom_block) CYCLE
490 latom_start = x_data%blocks(latom_block)%istart
491 latom_end = x_data%blocks(latom_block)%iend
571 IF (latom_block < katom_block) CYCLE
591 latom_end = x_data%blocks(latom_block)%iend
1026 IF (latom_block < katom_block) CYCLE
1036 latom_end = x_data%blocks(latom_block)%iend
1272 IF (latom_block < katom_block) CYCLE
1290 col = (iatom_block - 1)*nblocks + latom_block
1307 latom_start = x_data%blocks(latom_block)%istart
[all …]
H A Dhfx_derivatives.F136 INTEGER :: kind_kind_idx, kkind, kset, l_atom, l_max, latom, latom_block, latom_end, & local
910 latom_block = INT(MODULO(atom_block, nblocks)) + 1
913 IF (latom_block < katom_block) CYCLE
928 latom_start = actual_x_data%blocks(latom_block)%istart
929 latom_end = actual_x_data%blocks(latom_block)%iend
932 shm_pmax_block(latom_block, jatom_block), &
933 shm_pmax_block(latom_block, iatom_block) + &
H A Dhfx_energy_potential.F162 INTEGER :: katom_start, kind_kind_idx, kkind, kset, l_max, latom, latom_block, latom_end, & local
1135 latom_block = INT(MODULO(atom_block, nblocks)) + 1
1138 IF (latom_block < katom_block) CYCLE
1153 latom_start = actual_x_data%blocks(latom_block)%istart
1154 latom_end = actual_x_data%blocks(latom_block)%iend
1157 shm_pmax_block(latom_block, jatom_block), &
1158 shm_pmax_block(latom_block, iatom_block), &