Searched refs:almo_scf_pcg (Results 1 – 7 of 7) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | input_cp2k_almo.F | 20 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/))
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H A D | almo_scf.F | 71 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
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H A D | input_constants.F | 923 almo_scf_pcg = 3, & variable
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | almo_scf_env_methods.F | 21 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
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H A D | input_cp2k_almo.F | 21 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/))
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H A D | almo_scf.F | 66 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
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H A D | input_constants.F | 913 almo_scf_pcg = 3, & variable
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