dftfe::GaussianBasis Member List

This is the complete list of members for dftfe::GaussianBasis, including all inherited members.

BasisType enum name	dftfe::AtomicBasis
constructBasisSet(const std::vector< std::pair< std::string, std::vector< double > > > &atomCoords, const std::unordered_map< std::string, std::string > &atomBasisFileNames)	dftfe::GaussianBasis	virtual
d_angleTol	dftfe::GaussianBasis	private
d_atomSymbolsAndCoords	dftfe::GaussianBasis	private
d_atomToContractedGaussiansPtr	dftfe::GaussianBasis	private
d_gaussianBasisInfo	dftfe::GaussianBasis	private
d_rTol	dftfe::GaussianBasis	private
GaussianBasis(const double rTol=1e-10, const double angleTol=1e-10)	dftfe::GaussianBasis
getBasisGradient(const dftfe::uInt basisId, const std::vector< double > &x) const	dftfe::GaussianBasis	virtual
getBasisLaplacian(const dftfe::uInt basisId, const std::vector< double > &x) const	dftfe::GaussianBasis	virtual
getBasisValue(const dftfe::uInt basisId, const std::vector< double > &x) const	dftfe::GaussianBasis	virtual
getNumBasis() const	dftfe::GaussianBasis	virtual
~AtomicBasis()=default	dftfe::AtomicBasis
~GaussianBasis()	dftfe::GaussianBasis