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Searched refs:almo_scf_pcg (Results 1 – 7 of 7) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dinput_cp2k_almo.F20 almo_frz_none, almo_scf_diag, almo_scf_pcg, almo_scf_skip, almo_scf_trustr, atomic_guess, &
147 enum_i_vals=(/almo_scf_diag, almo_scf_pcg, almo_scf_skip/))
154 default_i_val=almo_scf_pcg, &
159 enum_i_vals=(/almo_scf_diag, almo_scf_pcg, almo_scf_trustr/))
H A Dalmo_scf.F71 almo_scf_diag, almo_scf_dm_sign, almo_scf_pcg, almo_scf_skip, almo_scf_trustr, &
947 CASE (almo_scf_pcg)
992 CASE (almo_scf_pcg)
1289 CASE (almo_scf_pcg)
1480 IF (almo_scf_env%xalmo_update_algorithm .EQ. almo_scf_pcg) THEN
1529 IF (almo_scf_env%xalmo_update_algorithm .EQ. almo_scf_pcg) THEN
1572 ELSE IF (almo_scf_env%xalmo_update_algorithm .EQ. almo_scf_pcg) THEN
1626 IF (almo_scf_env%xalmo_update_algorithm .EQ. almo_scf_pcg) THEN
H A Dinput_constants.F923 almo_scf_pcg = 3, & variable
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dalmo_scf_env_methods.F21 almo_occ_vol_penalty_none, almo_scf_diag, almo_scf_pcg, almo_scf_skip, cg_hager_zhang, &
408 almo_scf_env%xalmo_update_algorithm = almo_scf_pcg
H A Dinput_cp2k_almo.F21 almo_scf_pcg, almo_scf_skip, atomic_guess, cg_dai_yuan, cg_fletcher, cg_fletcher_reeves, &
145 enum_i_vals=(/almo_scf_diag, almo_scf_pcg, almo_scf_skip/))
H A Dalmo_scf.F66 almo_scf_diag, almo_scf_dm_sign, almo_scf_pcg, almo_scf_skip, atomic_guess, &
936 CASE (almo_scf_pcg)
979 CASE (almo_scf_pcg)
1276 CASE (almo_scf_pcg)
1498 IF (almo_scf_env%xalmo_update_algorithm .EQ. almo_scf_pcg) THEN
1531 ELSE IF (almo_scf_env%xalmo_update_algorithm .EQ. almo_scf_pcg) THEN
H A Dinput_constants.F913 almo_scf_pcg = 3, & variable