Searched defs:znucl (Results 1 – 9 of 9) sorted by path
| /dports/science/berkeleygw/BGW-2.0.0/MeanField/ABINIT/ |
| H A D | read_abi.f90 | 47 integer,allocatable:: znucl(:) component
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| /dports/science/jmol/jmol-14.32.7/src/org/jmol/adapter/readers/xtal/ |
| H A D | AbinitReader.java | 21 private float[] znucl; field in AbinitReader
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| /dports/science/py-abipy/abipy-0.9.0/abipy/abio/ |
| H A D | inputs.py | 360 def enforce_znucl_and_typat(self, znucl, typat): argument
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| /dports/science/py-pymol/pymol-open-source-2.4.0/contrib/uiuc/plugins/molfile_plugin/src/ |
| H A D | abinitplugin.c | 1278 int i, znucl[NATOM_MAX], ntypat; in write_structure() local
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| /dports/science/quantum-espresso/q-e-qe-6.7.0/upflib/ |
| H A D | gth.f90 | 526 real(dp) :: rcore, qcore, rc2, prefact, znucl, r2well, rloc, rrl, cc(4) local
684 subroutine gth_grid_for_rho(upf,znucl) argument
691 real(dp) :: znucl local
755 subroutine atmlength(densty,length,zion,znucl) argument
764 real(dp),intent(in) :: densty,zion,znucl local
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| /dports/science/siesta/siesta-4.1.5/Util/Macroave/Src/ |
| H A D | defs_common.f90 | 168 real(dp), pointer :: znucl(:) ! znucl(npsp) component
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| /dports/science/v_sim/v_sim-3.8.0/lib/plug-ins/abinit/ |
| H A D | abinit.c | 574 double *znucl, rprimd[3][3], *coord, *spinat; in loadAbinit() local
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| H A D | interfaces_41_geometry.F90 | 54 real(dp),intent(in) :: znucl(ntypat) local
450 real(dp), intent(in) :: znucl(ntypat) local
476 real(dp), intent(in) :: znucl(ntypat) local
515 real(dp), intent(in) :: znucl(npsp) local
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| /dports/science/v_sim/v_sim-3.8.0/src/dumpModules/ |
| H A D | dumpToABINIT.c | 97 int znucl; in writeDataInABINIT() local
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