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Searched defs:g4x6_list (Results 1 – 16 of 16) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dconstraint_4x6.F69 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 …]
H A Dconstraint_util.F78 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
H A Dtopology_constraint_util.F122 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
H A Drestraint.F287 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
H A Dforce_fields_util.F518 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dconstraint_4x6.F69 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 …]
H A Dconstraint_util.F78 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
H A Dtopology_constraint_util.F122 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
H A Drestraint.F287 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
H A Dforce_fields_util.F518 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/subsys/
H A Dmolecule_kind_types.F174 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
H A Dmolecule_types.F93 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list component
/dports/science/cp2k-data/cp2k-7.1.0/src/subsys/
H A Dmolecule_kind_types.F174 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
H A Dmolecule_types.F93 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list component
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/motion/thermostat/
H A Dthermostat_mapping.F841 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local
/dports/science/cp2k-data/cp2k-7.1.0/src/motion/thermostat/
H A Dthermostat_mapping.F841 TYPE(g4x6_constraint_type), DIMENSION(:), POINTER :: g4x6_list local