| /dports/science/py-gpaw/gpaw-21.6.0/gpaw/lcaotddft/ |
| H A D | densitymatrix.py | 6 def get_density(rho_MM, wfs, density, density_type='comp', u=0): function
81 def get_density(self, rho_uMM=None, density_type='comp'): member in DensityMatrix
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| H A D | ksdecomposition.py | 410 def get_density(self, wfs, rho_up, density='comp'): member in KohnShamDecomposition
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/util/ |
| H A D | get_density.F | 4 subroutine get_density(g_dens,g_vecs,theory,scftype,nalpha, subroutine
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/util/ |
| H A D | get_density.F | 4 subroutine get_density(g_dens,g_vecs,theory,scftype,nalpha, subroutine
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| /dports/science/py-gpaw/gpaw-21.6.0/gpaw/analyse/ |
| H A D | vdwradii.py | 44 def get_density(Z): function
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| H A D | hirshfeld.py | 49 def get_density(self, atom_indices=None, gridrefinement=2): member in HirshfeldDensity
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| /dports/math/py-cryptominisat/cryptominisat-5.8.0/src/ |
| H A D | gaussian.h | 211 inline double EGaussian::get_density() in get_density() function
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| /dports/math/cryptominisat/cryptominisat-5.8.0/src/ |
| H A D | gaussian.h | 211 inline double EGaussian::get_density() in get_density() function
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| /dports/science/py-gpaw/gpaw-21.6.0/gpaw/tddft/ |
| H A D | tdopers.py | 753 def get_density(self): member in DummyDensity
787 def get_density(self): member in TimeDependentDensity
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| /dports/science/erkale-pseudopotentials/erkale-870e772f09631b3dbdd99a18e4f3d4786d684a01/src/ |
| H A D | hirshfeld.cpp | 210 double Hirshfeld::get_density(size_t inuc, const coords_t & r) const { in get_density() function in Hirshfeld
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| H A D | dftgrid.cpp | 741 void AngularGrid::get_density(std::vector<dens_list_t> & list) const { in get_density() function in AngularGrid
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| /dports/science/erkale/erkale-8297aefe5aac9dbbb291e04c07661f3cff94a99a/src/ |
| H A D | hirshfeld.cpp | 210 double Hirshfeld::get_density(size_t inuc, const coords_t & r) const { in get_density() function in Hirshfeld
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| H A D | dftgrid.cpp | 741 void AngularGrid::get_density(std::vector<dens_list_t> & list) const { in get_density() function in AngularGrid
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| /dports/science/ergo/ergo-3.8/source/utilities/ |
| H A D | densitymanager.cc | 335 int get_density(const BasisInfoStruct & basisInfo, in get_density() function
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| /dports/print/tex-dvipdfmx/texlive-20150521-source/texk/dvipdfm-x/ |
| H A D | bmpimage.c | 88 get_density (double *xdensity, double *ydensity, struct hdr_info *hdr) in get_density() function
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| /dports/science/py-abipy/abipy-0.9.0/abipy/electrons/ |
| H A D | denpot.py | 451 def get_density(self, workdir=None): member in DensityFortranFile
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| /dports/science/py-pymol/pymol-open-source-2.4.0/modules/chempy/ |
| H A D | gamess1.py | 615 def get_density(self,brick,morb=0,run_prefix=None): member in State
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| /dports/audio/tosha/tosha-0.6/ |
| H A D | tosha.c | 77 get_density (int *density, int *secsize) in get_density() function
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| /dports/science/py-gpaw/gpaw-21.6.0/gpaw/fdtd/ |
| H A D | poisson_fdtd.py | 700 def get_density(self, global_array=False): member in FDTDPoissonSolver
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| /dports/science/mpqc/mpqc-2.3.1/src/lib/chemistry/qc/dft/ |
| H A D | dfttest.cc | 79 get_density(PointInputData::SpinData &d, const SCVector3 &r, in get_density() function
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| /dports/science/qmcpack/qmcpack-3.11.0/nexus/lib/ |
| H A D | fileio.py | 868 def get_density(self): member in XsfFile
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| /dports/devel/goffice/goffice-0.10.50/goffice/math/ |
| H A D | go-distribution.c | 110 double (*get_density) (GODistribution *dist, double x); member
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| /dports/math/cgal/CGAL-5.3/include/CGAL/OTR_2/ |
| H A D | Reconstruction_triangulation_2.h | 322 FT get_density(const Edge& edge) const { in get_density() function
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| /dports/science/dalton/dalton-66052b3af5ea7225e31178bf9a8b031913c72190/DALTON/dft/ |
| H A D | grid-gen2.c | 2974 get_density(DistributionSpecStruct** rhoPtr, in get_density() function
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| /dports/science/ergo/ergo-3.8/source/dft/ |
| H A D | grid_hicu.cc | 2488 get_density(const BasisInfoStruct& bis, in get_density() function
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