Home
last modified time | relevance | path

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

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dmolden_utils.F24 gto_spherical
175 IF (gto_kind == gto_spherical) THEN
215 ELSE IF (gto_kind == gto_spherical) THEN
320 ELSE IF (gto_kind == gto_spherical) THEN
H A Dinput_cp2k_properties_dft.F34 gto_cartesian, gto_spherical, oe_gllb, oe_lb, oe_none, oe_saop, oe_shift, &
1453 default_i_val=gto_spherical, &
1458 enum_i_vals=(/gto_cartesian, gto_spherical/))
H A Dinput_constants.F1148 gto_spherical = 2 variable
H A Dinput_cp2k_dft.F65 eri_operator_yukawa, gaussian, general_roks, gto_cartesian, gto_spherical, hf_model, &
1353 default_i_val=gto_spherical, &
1358 enum_i_vals=(/gto_cartesian, gto_spherical/))
2015 default_i_val=gto_spherical, &
2020 enum_i_vals=(/gto_cartesian, gto_spherical/))
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dmolden_utils.F24 gto_spherical
175 IF (gto_kind == gto_spherical) THEN
215 ELSE IF (gto_kind == gto_spherical) THEN
320 ELSE IF (gto_kind == gto_spherical) THEN
H A Dinput_constants.F1129 gto_spherical = 2 variable
H A Dinput_cp2k_dft.F63 eri_operator_yukawa, gaussian, general_roks, gto_cartesian, gto_spherical, hf_model, &
1299 default_i_val=gto_spherical, &
1304 enum_i_vals=(/gto_cartesian, gto_spherical/))
1899 default_i_val=gto_spherical, &
1904 enum_i_vals=(/gto_cartesian, gto_spherical/))