Searched refs:gto_spherical (Results 1 – 7 of 7) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | molden_utils.F | 24 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
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H A D | input_cp2k_properties_dft.F | 34 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/))
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H A D | input_constants.F | 1148 gto_spherical = 2 variable
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H A D | input_cp2k_dft.F | 65 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/))
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | molden_utils.F | 24 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
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H A D | input_constants.F | 1129 gto_spherical = 2 variable
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H A D | input_cp2k_dft.F | 63 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/))
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