| /dports/science/votca/votca-2021.2-18560-gfbe18d971/xtp/xtp-2a31d70/src/libxtp/gwbse/ |
| H A D | rpa.cc | 51 Index lumo = homo_ + 1; in ShiftUncorrectedEnergies() local
77 const Index lumo = homo_ + 1; in calculate_epsilon() local
123 const Index lumo = homo_ + 1; in calculate_epsilon_r() local
158 const Index lumo = homo_ + 1; in Diagonalize_H2p() local
206 const Index lumo = homo_ + 1; in Calculate_H2p_AmB() local
221 const Index lumo = homo_ + 1; in Calculate_H2p_ApB() local
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| /dports/science/votca/votca-2021.2-18560-gfbe18d971/xtp/src/libxtp/gwbse/ |
| H A D | rpa.cc | 51 Index lumo = homo_ + 1; in ShiftUncorrectedEnergies() local
77 const Index lumo = homo_ + 1; in calculate_epsilon() local
123 const Index lumo = homo_ + 1; in calculate_epsilon_r() local
158 const Index lumo = homo_ + 1; in Diagonalize_H2p() local
206 const Index lumo = homo_ + 1; in Calculate_H2p_AmB() local
221 const Index lumo = homo_ + 1; in Calculate_H2p_ApB() local
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| /dports/science/votca/votca-2021.2-18560-gfbe18d971/xtp/xtp-2a31d70/src/libxtp/self_energy_evaluators/ |
| H A D | sigma_exact.cc | 43 const Index lumo = opt_.homo + 1; in CalcCorrelationDiagElement() local
62 const Index lumo = opt_.homo + 1; in CalcCorrelationDiagElementDerivative() local
83 const Index lumo = opt_.homo + 1; in CalcCorrelationOffDiagElement() local
110 const Index lumo = opt_.homo + 1; in CalcResidues() local
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| H A D | sigma_ppm.cc | 39 const Index lumo = opt_.homo + 1; in CalcCorrelationDiagElement() local
65 const Index lumo = opt_.homo + 1; in CalcCorrelationDiagElementDerivative() local
93 const Index lumo = opt_.homo + 1; in CalcCorrelationOffDiagElement() local
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| H A D | sigma_cda.cc | 92 Index lumo = homo + 1; in CalcResidueContribution() local
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| /dports/science/votca/votca-2021.2-18560-gfbe18d971/xtp/src/libxtp/self_energy_evaluators/ |
| H A D | sigma_exact.cc | 43 const Index lumo = opt_.homo + 1; in CalcCorrelationDiagElement() local
62 const Index lumo = opt_.homo + 1; in CalcCorrelationDiagElementDerivative() local
83 const Index lumo = opt_.homo + 1; in CalcCorrelationOffDiagElement() local
110 const Index lumo = opt_.homo + 1; in CalcResidues() local
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| H A D | sigma_ppm.cc | 39 const Index lumo = opt_.homo + 1; in CalcCorrelationDiagElement() local
65 const Index lumo = opt_.homo + 1; in CalcCorrelationDiagElementDerivative() local
93 const Index lumo = opt_.homo + 1; in CalcCorrelationOffDiagElement() local
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| H A D | sigma_cda.cc | 92 Index lumo = homo + 1; in CalcResidueContribution() local
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| /dports/science/py-avogadrolibs/avogadrolibs-1.94.0/avogadro/core/ |
| H A D | basisset.h | 136 bool lumo(unsigned int n) { return n == lumo(); } in lumo() function
140 unsigned int lumo() const { return m_electrons[0] / 2 + 1; } in lumo() function
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| /dports/science/avogadrolibs/avogadrolibs-1.94.0/avogadro/core/ |
| H A D | basisset.h | 136 bool lumo(unsigned int n) { return n == lumo(); } in lumo() function
140 unsigned int lumo() const { return m_electrons[0] / 2 + 1; } in lumo() function
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| /dports/science/ergo/ergo-3.8/source/matrix/ |
| H A D | TC2.h | 340 Treal TC2<Treal, Tmatrix>::lumo(Treal tol) const { in lumo() function
341 Treal lumo = 1; in lumo() local
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| H A D | Perturbation.h | 142 Treal lumo; in dryRun() local
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| /dports/science/ergo/ergo-3.8/source/test/recursive_expansion_tests/ |
| H A D | recexp_eigenv_test.cc | 224 ergo_real lumo = eigvalList[N_occ]; in test1() local
472 ergo_real lumo = eigvalList[N_occ]; in test2() local
665 ergo_real lumo = eigvalList[N_occ]; in test3() local
861 ergo_real lumo = eigvalList[N_occ]; in test4() local
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| H A D | recexp_randsym_test.cc | 152 ergo_real lumo = eigvalList[N_occ ]; in main() local
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| H A D | recexp_diag_test.cc | 211 ergo_real lumo = eigvalList[N_occ ]; in main() local
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| H A D | recexp_test.cc | 208 ergo_real lumo = eigvalList[N_occ ]; in main() local
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| H A D | recexp_sprandsym.cc | 266 ergo_real lumo = eigvalList[N_occ ]; in main() local
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| /dports/science/votca/votca-2021.2-18560-gfbe18d971/xtp/xtp-2a31d70/src/libxtp/ |
| H A D | ImaginaryAxisIntegration.cc | 91 Index lumo = opt_.homo + 1; in SigmaGQDiag() local
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| /dports/science/votca/votca-2021.2-18560-gfbe18d971/xtp/src/libxtp/ |
| H A D | ImaginaryAxisIntegration.cc | 91 Index lumo = opt_.homo + 1; in SigmaGQDiag() local
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| /dports/multimedia/xvid/xvidcore/src/plugins/ |
| H A D | plugin_ssim.c | 282 void consim_gaussian(uint8_t* ptro, uint8_t* ptrc, int stride, int lumo, int lumc, int* pdevo, int*… in consim_gaussian()
312 void consim_gaussian_int(uint8_t* ptro, uint8_t* ptrc, int stride, int lumo, int lumc, int* pdevo, … in consim_gaussian_int()
347 void consim_c(uint8_t* ptro, uint8_t* ptrc, int stride, int lumo, int lumc, int* pdevo, int* pdevc,… in consim_c()
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwdft/so_dft/ |
| H A D | dft_scf_utils_so.F | 4 subroutine calc_homolumogap(k_eval,nelec,rlshift,homo,lumo,gap) argument
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwdft/so_dft/ |
| H A D | dft_scf_utils_so.F | 4 subroutine calc_homolumogap(k_eval,nelec,rlshift,homo,lumo,gap) argument
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| /dports/science/berkeleygw/BGW-2.0.0/MeanField/EPM/ |
| H A D | epm.f90 | 48 real(double) :: homo, lumo, gap, e1, e2, e3, d12, d23 variable
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| /dports/science/erkale-pseudopotentials/erkale-870e772f09631b3dbdd99a18e4f3d4786d684a01/src/casida/ |
| H A D | main.cpp | 55 size_t lumo; in parse_states() local
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| /dports/science/erkale/erkale-8297aefe5aac9dbbb291e04c07661f3cff94a99a/src/casida/ |
| H A D | main.cpp | 55 size_t lumo; in parse_states() local
|