/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | constraint_4x6.F | 69 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 109 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 141 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 177 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 216 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 256 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 288 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 324 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 357 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 621 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local [all …]
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H A D | constraint_util.F | 78 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 139 SUBROUTINE getold_low(n3x3con, n4x6con, colv_list, g3x3_list, g4x6_list, fixd_list, & argument 145 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 218 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 288 SUBROUTINE pv_constraint_low(ng3x3, ng4x6, g3x3_list, g4x6_list, colv_list, & argument 293 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local
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H A D | topology_constraint_util.F | 122 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local 1007 SUBROUTINE setup_g4x6_list(g4x6_list, ilist, cons_info, ng4x6_restraint) argument 1008 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local 1244 SUBROUTINE setup_lg4x6(lg4x6, g4x6_list, first_atom, last_atom) argument 1247 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local
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H A D | restraint.F | 287 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 385 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 502 SUBROUTINE restraint_4x6_low(ng4x6, g4x6_list, fixd_list, first_atom, & argument 506 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local
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H A D | force_fields_util.F | 518 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | constraint_4x6.F | 69 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 109 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 141 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 177 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 216 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 256 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 288 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 324 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 357 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 621 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local [all …]
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H A D | constraint_util.F | 78 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 139 SUBROUTINE getold_low(n3x3con, n4x6con, colv_list, g3x3_list, g4x6_list, fixd_list, & argument 145 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 218 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 288 SUBROUTINE pv_constraint_low(ng3x3, ng4x6, g3x3_list, g4x6_list, colv_list, & argument 293 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local
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H A D | topology_constraint_util.F | 122 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local 1007 SUBROUTINE setup_g4x6_list(g4x6_list, ilist, cons_info, ng4x6_restraint) argument 1008 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local 1244 SUBROUTINE setup_lg4x6(lg4x6, g4x6_list, first_atom, last_atom) argument 1247 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local
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H A D | restraint.F | 287 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 385 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local 502 SUBROUTINE restraint_4x6_low(ng4x6, g4x6_list, fixd_list, first_atom, & argument 506 TYPE(g4x6_constraint_type), POINTER :: g4x6_list(:) local
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H A D | force_fields_util.F | 518 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/subsys/ |
H A D | molecule_kind_types.F | 174 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list component 571 g3x3_list, g4x6_list, vsite_list, torsion_list, shell_list, & argument 595 OPTIONAL, POINTER :: g4x6_list local 865 g3x3_list, ng4x6, nfixd, g4x6_list, nvsite, & argument 902 OPTIONAL, POINTER :: g4x6_list local
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H A D | molecule_types.F | 93 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list component
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/dports/science/cp2k-data/cp2k-7.1.0/src/subsys/ |
H A D | molecule_kind_types.F | 174 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list component 571 g3x3_list, g4x6_list, vsite_list, torsion_list, shell_list, & argument 595 OPTIONAL, POINTER :: g4x6_list local 865 g3x3_list, ng4x6, nfixd, g4x6_list, nvsite, & argument 902 OPTIONAL, POINTER :: g4x6_list local
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H A D | molecule_types.F | 93 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list component
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/motion/thermostat/ |
H A D | thermostat_mapping.F | 841 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local
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/dports/science/cp2k-data/cp2k-7.1.0/src/motion/thermostat/ |
H A D | thermostat_mapping.F | 841 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local
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