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Searched defs:last_shell (Results 1 – 10 of 10) sorted by relevance

/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/subsys/
H A Dmolecule_types.F108 … INTEGER :: last_shell ! global index of last shell atom in molecule component
294 first_atom, last_atom, first_shell, last_shell) argument
308 last_shell local
/dports/science/cp2k-data/cp2k-7.1.0/src/subsys/
H A Dmolecule_types.F108 … INTEGER :: last_shell ! global index of last shell atom in molecule component
294 first_atom, last_atom, first_shell, last_shell) argument
308 last_shell local
/dports/science/qwalk/mainline-1.0.1-300-g1b7e381/src/converter/
H A Dheg2qmc.cpp784 int last_shell; in write_jast2() local
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/motion/thermostat/
H A Dthermostat_mapping.F191 imol, imol_local, ipart, jj, k, kk, last_atom, last_shell, nglob_cns, nmol_local, number local
644 imol_local, ipart, itmp, jj, k, kk, last_atom, last_shell, nglob_cns, nmol_local local
/dports/science/cp2k-data/cp2k-7.1.0/src/motion/thermostat/
H A Dthermostat_mapping.F191 imol, imol_local, ipart, jj, k, kk, last_atom, last_shell, nglob_cns, nmol_local, number local
644 imol_local, ipart, itmp, jj, k, kk, last_atom, last_shell, nglob_cns, nmol_local local
/dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/gen1int/
H A Dgen1int_shell.F90116 powers, last_shell, sub_shell) argument
126 type(sub_shell_t), optional, intent(in) :: last_shell local
/dports/devel/kBuild/kBuild-0.1.9998/src/kmk/
H A Djob.c3519 static const char *last_shell = ""; in construct_command_argv() local
/dports/devel/gmake/make-4.3/src/
H A Djob.c3657 static const char *last_shell = ""; in construct_command_argv() local
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Dforce_fields_all.F2362 j, last, last_shell, n, natom, nmol, & local
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Dforce_fields_all.F2362 j, last, last_shell, n, natom, nmol, & local