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Searched refs:MOLFILE_SCFTYPE_RHF (Results 1 – 6 of 6) sorted by relevance

/dports/science/py-pymol/pymol-open-source-2.4.0/contrib/uiuc/plugins/include/
H A Dmolfile_plugin.h298 #define MOLFILE_SCFTYPE_RHF 1 /* restricted Hartree-Fock */ macro
/dports/science/py-rmf/rmf-1.3.1/plugins/vmd/include/
H A Dmolfile_plugin.h241 #define MOLFILE_SCFTYPE_RHF 1 /* restricted Hartree-Fock */ macro
/dports/science/plumed/plumed2-2.7.2/src/molfile/
H A Dmolfile_plugin.h339 #define MOLFILE_SCFTYPE_RHF 1 /* restricted Hartree-Fock */ macro
/dports/science/rmf/rmf-1.3.1/plugins/vmd/include/
H A Dmolfile_plugin.h241 #define MOLFILE_SCFTYPE_RHF 1 /* restricted Hartree-Fock */ macro
/dports/science/lammps/lammps-stable_29Sep2021/lib/molfile/
H A Dmolfile_plugin.h343 #define MOLFILE_SCFTYPE_RHF 1 /* restricted Hartree-Fock */ macro
/dports/science/py-pymol/pymol-open-source-2.4.0/contrib/uiuc/plugins/molfile_plugin/src/
H A Dgamessplugin.c1778 data->scftype = MOLFILE_SCFTYPE_RHF; in get_contrl_firefly()
1919 data->scftype = MOLFILE_SCFTYPE_RHF; in get_contrl()