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

/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dhfx_energy_potential.F154 INTEGER :: act_atomic_block_offset, act_set_offset, atomic_offset_ac, atomic_offset_ad, & local
1283 atomic_offset_ac = shm_atomic_block_offset(iatom, katom)
1683 … atomic_offset_bd, atomic_offset_bc, atomic_offset_ad, atomic_offset_ac)
2461 atomic_offset_ac) argument
2475 atomic_offset_ad, atomic_offset_ac local
2551 offset_ac = offset_ac_set(iset, kset) + atomic_offset_ac - 1
2562 offset_ac = offset_ac_set(kset, iset) + atomic_offset_ac - 1
2710 atomic_offset_ac) argument
2724 atomic_offset_ad, atomic_offset_ac local
2800 offset_ac = offset_ac_set(iset, kset) + atomic_offset_ac - 1
[all …]
H A Dhfx_derivatives.F125 INTEGER :: atomic_offset_ac, atomic_offset_ad, atomic_offset_bc, atomic_offset_bd, bin, & local
1069 atomic_offset_ac = shm_atomic_block_offset(iatom, katom)
1388 … atomic_offset_ad, atomic_offset_ac, is_anti_symmetric)
1394 … atomic_offset_ad, atomic_offset_ac, is_anti_symmetric)
1401 … atomic_offset_ad, atomic_offset_ac, is_anti_symmetric)
1410 … atomic_offset_ad, atomic_offset_ac, is_anti_symmetric)
1416 … atomic_offset_ad, atomic_offset_ac, is_anti_symmetric)
2040 atomic_offset_ad, atomic_offset_ac, anti_symmetric) argument
2050 atomic_offset_ad, atomic_offset_ac local
2130 offset_ac = offset_ac_set(iset, kset) + atomic_offset_ac - 1
[all …]
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dhfx_energy_potential.F154 INTEGER :: act_atomic_block_offset, act_set_offset, atomic_offset_ac, atomic_offset_ad, & local
1283 atomic_offset_ac = shm_atomic_block_offset(iatom, katom)
1683 … atomic_offset_bd, atomic_offset_bc, atomic_offset_ad, atomic_offset_ac)
2461 atomic_offset_ac) argument
2475 atomic_offset_ad, atomic_offset_ac local
2551 offset_ac = offset_ac_set(iset, kset) + atomic_offset_ac - 1
2562 offset_ac = offset_ac_set(kset, iset) + atomic_offset_ac - 1
2710 atomic_offset_ac) argument
2724 atomic_offset_ad, atomic_offset_ac local
2800 offset_ac = offset_ac_set(iset, kset) + atomic_offset_ac - 1
[all …]
H A Dhfx_derivatives.F129 INTEGER :: atomic_offset_ac, atomic_offset_ad, atomic_offset_bc, atomic_offset_bd, bin, & local
1077 atomic_offset_ac = shm_atomic_block_offset(iatom, katom)
1399 … atomic_offset_ad, atomic_offset_ac, is_anti_symmetric)
1405 … atomic_offset_ad, atomic_offset_ac, is_anti_symmetric)
1412 … atomic_offset_ad, atomic_offset_ac, is_anti_symmetric)
1421 … atomic_offset_ad, atomic_offset_ac, is_anti_symmetric)
1427 … atomic_offset_ad, atomic_offset_ac, is_anti_symmetric)
2054 atomic_offset_ad, atomic_offset_ac, anti_symmetric) argument
2064 atomic_offset_ad, atomic_offset_ac local
2144 offset_ac = offset_ac_set(iset, kset) + atomic_offset_ac - 1
[all …]