/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | force_field_types.F | 71 CHARACTER(LEN=default_string_length), POINTER :: torsion_c(:) component 114 CHARACTER(LEN=default_string_length), POINTER :: torsion_c(:) component 314 NULLIFY (chm_info%torsion_c) 355 NULLIFY (amb_info%torsion_c) 410 NULLIFY (inp_info%torsion_c) 611 IF (ASSOCIATED(chm_info%torsion_c)) THEN 612 DEALLOCATE (chm_info%torsion_c) 711 IF (ASSOCIATED(amb_info%torsion_c)) THEN 712 DEALLOCATE (amb_info%torsion_c) 862 IF (ASSOCIATED(inp_info%torsion_c)) THEN [all …]
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H A D | force_fields_ext.F | 517 CALL reallocate(chm_info%torsion_c, 1, ntorsion) 524 chm_info%torsion_c(ntorsion) = string3 532 TRIM(chm_info%torsion_c(ntorsion)), " ", & 755 TRIM(amb_info%torsion_c(i)), " ", &
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H A D | force_fields.F | 264 ff_type%amb_info%torsion_c(i), &
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H A D | force_fields_all.F | 1350 ((chm_info%torsion_c(k)) == (name_atm_c)) .AND. & 1354 ((chm_info%torsion_c(k)) == (name_atm_b)) .AND. & 1373 ((chm_info%torsion_c(k)) == (name_atm_c)) .AND. & 1377 ((chm_info%torsion_c(k)) == (name_atm_b)) .AND. & 1399 ((amb_info%torsion_c(k)) == (name_atm_c)) .AND. & 1403 ((amb_info%torsion_c(k)) == (name_atm_b)) .AND. & 1422 ((amb_info%torsion_c(k)) == (name_atm_c)) .AND. & 1426 ((amb_info%torsion_c(k)) == (name_atm_b)) .AND. & 1448 ((inp_info%torsion_c(k)) == (name_atm_c)) .AND. & 1452 ((inp_info%torsion_c(k)) == (name_atm_b)) .AND. &
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H A D | topology_amber.F | 836 CALL reallocate(amb_info%torsion_c, 1, buffer_size) 844 … amb_info%torsion_c, amb_info%torsion_d, amb_info%torsion_k, & 849 … amb_info%torsion_c, amb_info%torsion_d, amb_info%torsion_k, & 855 CALL reallocate(amb_info%torsion_c, 1, nsize)
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H A D | force_fields_input.F | 394 CALL reallocate(inp_info%torsion_c, 1, ntors) 400 … inp_info%torsion_c, inp_info%torsion_d, inp_info%torsion_k, inp_info%torsion_phi0, & 1785 …SUBROUTINE read_torsions_section(torsion_kind, torsion_a, torsion_b, torsion_c, torsion_d, torsion… argument 1789 DIMENSION(:), POINTER :: torsion_a, torsion_b, torsion_c, & local 1810 torsion_c(start + isec) = atm_names(3) 1814 CALL uppercase(torsion_c(start + isec))
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | force_field_types.F | 71 CHARACTER(LEN=default_string_length), POINTER :: torsion_c(:) component 114 CHARACTER(LEN=default_string_length), POINTER :: torsion_c(:) component 314 NULLIFY (chm_info%torsion_c) 355 NULLIFY (amb_info%torsion_c) 410 NULLIFY (inp_info%torsion_c) 611 IF (ASSOCIATED(chm_info%torsion_c)) THEN 612 DEALLOCATE (chm_info%torsion_c) 711 IF (ASSOCIATED(amb_info%torsion_c)) THEN 712 DEALLOCATE (amb_info%torsion_c) 862 IF (ASSOCIATED(inp_info%torsion_c)) THEN [all …]
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H A D | force_fields_ext.F | 517 CALL reallocate(chm_info%torsion_c, 1, ntorsion) 524 chm_info%torsion_c(ntorsion) = string3 532 TRIM(chm_info%torsion_c(ntorsion)), " ", & 755 TRIM(amb_info%torsion_c(i)), " ", &
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H A D | force_fields.F | 264 ff_type%amb_info%torsion_c(i), &
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H A D | force_fields_all.F | 1350 ((chm_info%torsion_c(k)) == (name_atm_c)) .AND. & 1354 ((chm_info%torsion_c(k)) == (name_atm_b)) .AND. & 1373 ((chm_info%torsion_c(k)) == (name_atm_c)) .AND. & 1377 ((chm_info%torsion_c(k)) == (name_atm_b)) .AND. & 1399 ((amb_info%torsion_c(k)) == (name_atm_c)) .AND. & 1403 ((amb_info%torsion_c(k)) == (name_atm_b)) .AND. & 1422 ((amb_info%torsion_c(k)) == (name_atm_c)) .AND. & 1426 ((amb_info%torsion_c(k)) == (name_atm_b)) .AND. & 1448 ((inp_info%torsion_c(k)) == (name_atm_c)) .AND. & 1452 ((inp_info%torsion_c(k)) == (name_atm_b)) .AND. &
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H A D | topology_amber.F | 836 CALL reallocate(amb_info%torsion_c, 1, buffer_size) 844 … amb_info%torsion_c, amb_info%torsion_d, amb_info%torsion_k, & 849 … amb_info%torsion_c, amb_info%torsion_d, amb_info%torsion_k, & 855 CALL reallocate(amb_info%torsion_c, 1, nsize)
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H A D | force_fields_input.F | 394 CALL reallocate(inp_info%torsion_c, 1, ntors) 400 … inp_info%torsion_c, inp_info%torsion_d, inp_info%torsion_k, inp_info%torsion_phi0, & 1785 …SUBROUTINE read_torsions_section(torsion_kind, torsion_a, torsion_b, torsion_c, torsion_d, torsion… argument 1789 DIMENSION(:), POINTER :: torsion_a, torsion_b, torsion_c, & local 1810 torsion_c(start + isec) = atm_names(3) 1814 CALL uppercase(torsion_c(start + isec))
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/dports/science/chrono/chrono-7.0.1/src/chrono_vehicle/tracked_vehicle/suspension/ |
H A D | LinearDamperRWAssembly.cpp | 71 double torsion_c = d["Torsional Spring"]["Damping Coefficient"].GetDouble(); in Create() local 73 … chrono_types::make_shared<LinearSpringDamperActuatorTorque>(torsion_k, torsion_c, torsion_t, tors… in Create()
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H A D | RotationalDamperRWAssembly.cpp | 71 double torsion_c = d["Torsional Spring"]["Damping Coefficient"].GetDouble(); in Create() local 73 … chrono_types::make_shared<LinearSpringDamperActuatorTorque>(torsion_k, torsion_c, torsion_t, tors… in Create()
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