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

/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dadmm_types.F163 fm_struct_nmo_nmo, fm_struct_orb_aux, fm_struct_orb_nmo, fm_struct_orb_orb local
252 CALL cp_fm_struct_create(fm_struct_nmo_nmo, &
259 … CALL cp_fm_create(admm_env%work_nmo_nmo1(ispin)%matrix, fm_struct_nmo_nmo, name="work_nmo_nmo1")
260 … CALL cp_fm_create(admm_env%R_schur_R_t(ispin)%matrix, fm_struct_nmo_nmo, name="R_schur_R_t")
261 … CALL cp_fm_create(admm_env%work_nmo_nmo2(ispin)%matrix, fm_struct_nmo_nmo, name="work_nmo_nmo2")
262 CALL cp_fm_create(admm_env%lambda(ispin)%matrix, fm_struct_nmo_nmo, name="lambda")
263 CALL cp_fm_create(admm_env%lambda_inv(ispin)%matrix, fm_struct_nmo_nmo, name="lambda_inv")
265 CALL cp_fm_create(admm_env%R(ispin)%matrix, fm_struct_nmo_nmo, name="R")
270 CALL cp_fm_create(admm_env%M(ispin)%matrix, fm_struct_nmo_nmo, name="M")
277 … CALL cp_fm_create(admm_env%lambda_inv2(ispin)%matrix, fm_struct_nmo_nmo, name="lambda_inv2")
[all …]
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dadmm_types.F190 fm_struct_nmo_nmo, fm_struct_orb_aux, fm_struct_orb_nmo, fm_struct_orb_orb local
279 CALL cp_fm_struct_create(fm_struct_nmo_nmo, &
286 … CALL cp_fm_create(admm_env%work_nmo_nmo1(ispin)%matrix, fm_struct_nmo_nmo, name="work_nmo_nmo1")
287 … CALL cp_fm_create(admm_env%R_schur_R_t(ispin)%matrix, fm_struct_nmo_nmo, name="R_schur_R_t")
288 … CALL cp_fm_create(admm_env%work_nmo_nmo2(ispin)%matrix, fm_struct_nmo_nmo, name="work_nmo_nmo2")
289 CALL cp_fm_create(admm_env%lambda(ispin)%matrix, fm_struct_nmo_nmo, name="lambda")
290 CALL cp_fm_create(admm_env%lambda_inv(ispin)%matrix, fm_struct_nmo_nmo, name="lambda_inv")
292 CALL cp_fm_create(admm_env%R(ispin)%matrix, fm_struct_nmo_nmo, name="R")
297 CALL cp_fm_create(admm_env%M(ispin)%matrix, fm_struct_nmo_nmo, name="M")
304 … CALL cp_fm_create(admm_env%lambda_inv2(ispin)%matrix, fm_struct_nmo_nmo, name="lambda_inv2")
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