| /dports/science/code_saturne/code_saturne-7.1.0/src/atmo/ |
| H A D | atprop.f90 | 27 subroutine atprop subroutine
52 integer f_id, idim1, ityloc, itycat
|
| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | ewald_methods_tb.F | 84 gmcharge, mcharge, calculate_forces, virial, use_virial, atprop) argument
95 TYPE(atprop_type), POINTER :: atprop local
348 SUBROUTINE tb_ewald_overlap(gmcharge, mcharge, alpha, n_list, virial, use_virial, atprop) argument
357 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qs_energy_utils.F | 220 TYPE(atprop_type), POINTER :: atprop local
326 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qs_subsys_types.F | 156 natom, nparticle, ncore, nshell, nkind, atprop, virial, & argument
181 TYPE(atprop_type), OPTIONAL, POINTER :: atprop local
|
| H A D | se_fock_matrix.F | 91 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qs_core_energies.F | 216 TYPE(atprop_type), POINTER :: atprop local
360 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | se_core_core.F | 95 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qmmm_tb_coulomb.F | 94 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qs_dftb_dispersion.F | 121 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | pme.F | 95 fgshell_coulomb, fgcore_coulomb, use_virial, charges, atprop) argument
109 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qs_gcp_method.F | 87 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qs_dftb3_methods.F | 98 TYPE(atprop_type), POINTER :: atprop local
|
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | ewald_methods_tb.F | 84 gmcharge, mcharge, calculate_forces, virial, use_virial, atprop) argument
95 TYPE(atprop_type), POINTER :: atprop local
348 SUBROUTINE tb_ewald_overlap(gmcharge, mcharge, alpha, n_list, virial, use_virial, atprop) argument
357 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qs_energy_utils.F | 220 TYPE(atprop_type), POINTER :: atprop local
326 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qs_subsys_types.F | 156 natom, nparticle, ncore, nshell, nkind, atprop, virial, & argument
181 TYPE(atprop_type), OPTIONAL, POINTER :: atprop local
|
| H A D | se_fock_matrix.F | 91 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qs_core_energies.F | 216 TYPE(atprop_type), POINTER :: atprop local
360 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | se_core_core.F | 95 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qs_dftb_dispersion.F | 121 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qmmm_tb_coulomb.F | 94 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | pme.F | 95 fgshell_coulomb, fgcore_coulomb, use_virial, charges, atprop) argument
109 TYPE(atprop_type), POINTER :: atprop local
|
| H A D | qs_gcp_method.F | 87 TYPE(atprop_type), POINTER :: atprop local
|
| /dports/biology/ugene/ugene-40.1/src/plugins_3rdparty/ptools/src/ptools/ |
| H A D | rigidbody.h | 97 void SetAtomProperty(uint pos, const Atomproperty& atprop) in SetAtomProperty()
|
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/subsys/ |
| H A D | cp_subsys_types.F | 109 TYPE(atprop_type), POINTER :: atprop => Null() component
347 natom, nparticle, ncore, nshell, nkind, atprop, virial, & argument
372 TYPE(atprop_type), OPTIONAL, POINTER :: atprop local
|
| /dports/science/cp2k-data/cp2k-7.1.0/src/subsys/ |
| H A D | cp_subsys_types.F | 109 TYPE(atprop_type), POINTER :: atprop => Null() component
347 natom, nparticle, ncore, nshell, nkind, atprop, virial, & argument
372 TYPE(atprop_type), OPTIONAL, POINTER :: atprop local
|