| /dports/science/mpqc/mpqc-2.3.1/src/lib/chemistry/qc/basis/ |
| H A D | sobasis.h | 125 int naofunction(int ishell) const { return naofunc_[ishell]; } in naofunction()
153 SOBasis::function(int ishell) in function()
159 SOBasis::irrep(int ishell, int ifunc) const in irrep()
175 SOBasis::function_within_irrep(int ishell, int ifunc) const in function_within_irrep()
181 SOBasis::nfunction(int ishell, int iirrep) const in nfunction()
187 SOBasis::function_offset_within_shell(int ishell, int iirrep) const in function_offset_within_shell()
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| H A D | gaussbas.h | 424 int shell_to_center(int ishell) const { return shell_to_center_[ishell]; } in shell_to_center()
426 int shell_to_primitive(int ishell) const {return shell_to_primitive_[ishell]; } in shell_to_primitive()
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| H A D | gaussbas.cc | 464 int ishell = 0; in init() local
576 int ishell = 0; in init2() local
683 GaussianBasisSet::get_shells_(int& ishell, Ref<KeyVal>& keyval, const char* element, const char* ba… in get_shells_()
749 GaussianBasisSet::get_even_temp_shells_(int& ishell, Ref<KeyVal>& keyval, const char* element, cons… in get_even_temp_shells_()
887 recursively_get_shell(int&ishell,Ref<KeyVal>&keyval, in recursively_get_shell()
1068 GaussianBasisSet::operator()(int icenter,int ishell) in operator ()()
1123 for (int ishell=0; ishell < center_to_nshell_[icenter]; ishell++) { in print() local
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| /dports/x11-wm/fvwm3/fvwm3-1.0.4/bin/FvwmPrompt/vendor/github.com/abiosoft/ishell/ |
| H A D | utils_unix.go | 3 package ishell package
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| H A D | utils_windows.go | 3 package ishell package
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| H A D | completer.go | 1 package ishell package
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| H A D | functions.go | 1 package ishell package
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| H A D | context.go | 1 package ishell package
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| H A D | README.md | 1 # ishell chapter
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| /dports/devel/ipython5/ipython-5.10.0/IPython/lib/ |
| H A D | inputhookqt4.py | 161 def preprompthook_qt4(ishell): argument
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| /dports/devel/ipython/ipython-7.29.0/IPython/lib/ |
| H A D | inputhookqt4.py | 161 def preprompthook_qt4(ishell): argument
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| /dports/science/bagel/bagel-1.2.2/src/util/io/ |
| H A D | moldenout.cc | 99 for (auto& ishell : shells) { in write_aos() local
145 for (auto& ishell : iatom->shells()) { in write_mos() local
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| /dports/java/eclipse-pydev/eclipse-pydev-8.2.0/plugins/org.python.pydev.core_8.2.0.202102211157/pysrc/pydev_ipython/ |
| H A D | inputhookqt4.py | 177 def preprompthook_qt4(ishell): argument
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| H A D | inputhookqt5.py | 178 def preprompthook_qt5(ishell): argument
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| /dports/devel/pycharm-pro/pycharm-2020.2.3/plugins/python/helpers/pydev/pydev_ipython/ |
| H A D | inputhookqt4.py | 177 def preprompthook_qt4(ishell): argument
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| H A D | inputhookqt5.py | 180 def preprompthook_qt5(ishell): argument
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| /dports/devel/py-pydevd/pydevd-1.1.1/pydev_ipython/ |
| H A D | inputhookqt4.py | 177 def preprompthook_qt4(ishell): argument
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| H A D | inputhookqt5.py | 178 def preprompthook_qt5(ishell): argument
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| /dports/devel/py-debugpy/debugpy-1.5.1/src/debugpy/_vendored/pydevd/pydev_ipython/ |
| H A D | inputhookqt5.py | 178 def preprompthook_qt5(ishell): argument
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| H A D | inputhookqt4.py | 177 def preprompthook_qt4(ishell): argument
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| /dports/devel/py-prettyprinter/prettyprinter-0.18.0/prettyprinter/extras/ |
| H A D | ipython.py | 22 def pygments_style_from_name_or_cls(name_or_cls, ishell): argument
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| /dports/science/mpqc/mpqc-2.3.1/src/lib/chemistry/cca/ |
| H A D | basis_cca_to_sc.cc | 62 for(int ishell=0; ishell<atomic.get_n_shell(); ++ishell) { in basis_cca_to_sc() local
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| /dports/science/wxmacmolplt/wxmacmolplt-7.7-43-g9a46f7a/src/ |
| H A D | BasisSet.cpp | 76 for (long ishell=0; ishell<NumShells; ishell++) { in Normalize() local
127 long ishell, iprim; in WriteBasis() local
872 for (long ishell=0; ishell<NumShells; ishell++) { in ParseGAMESSBasisSet() local
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/NWints/auxil/ |
| H A D | int_spcart2.F | 44 integer ishell ! loop index over shells local
243 integer ishell local
336 integer ishell local
429 integer ishell local
524 integer ishell local
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/NWints/auxil/ |
| H A D | int_spcart2.F | 44 integer ishell ! loop index over shells local
243 integer ishell local
336 integer ishell local
429 integer ishell local
524 integer ishell local
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