QMCBasisFunction Member List
This is the complete list of members for
QMCBasisFunction, including all inherited members.
| angularGrid(Array2D< double > &grid, int nuc, Array2D< Array1D< double > > &angularCi) | QMCBasisFunction | |
| basisFunctionsOnGrid(Array2D< double > &grid, int nuc, Array2D< Array1D< double > > &angularCi, Array2D< qmcfloat > &chi_val) | QMCBasisFunction | |
| BFCoeffs | QMCBasisFunction | [protected] |
| BFLookupTable | QMCBasisFunction | [protected] |
| evaluateBasisFunctions(Array2D< double > &X, Array2D< qmcfloat > &chi_value) | QMCBasisFunction | |
| evaluateBasisFunctions(Array2D< double > &X, int start, int stop, Array2D< qmcfloat > &chi_value, Array2D< qmcfloat > &chi_grx, Array2D< qmcfloat > &chi_gry, Array2D< qmcfloat > &chi_grz, Array2D< qmcfloat > &chi_laplacian) | QMCBasisFunction | |
| flags | QMCBasisFunction | [protected] |
| getBFCoeffs(int i) | QMCBasisFunction | |
| getNumberBasisFunctions(int i) | QMCBasisFunction | |
| initialize(QMCFlags *flags, QMCMolecule *molecule) | QMCBasisFunction | |
| initializeInterpolation(int bfc_number, int orbital, CubicSplineWithGeometricProgressionGrid &S, int whichDerivative) | QMCBasisFunction | [private] |
| initializeInterpolations() | QMCBasisFunction | [private] |
| Molecule | QMCBasisFunction | [protected] |
| N_BasisFunctions | QMCBasisFunction | [protected] |
| operator<<(ostream &strm, QMCBasisFunction &rhs) | QMCBasisFunction | [friend] |
| operator=(const QMCBasisFunction &rhs) | QMCBasisFunction | |
| operator>>(istream &strm, QMCBasisFunction &rhs) | QMCBasisFunction | [friend] |
| QMCBasisFunction() | QMCBasisFunction | |
| QMCPsiPotential class | QMCBasisFunction | [friend] |
| radialFunction(QMCBasisFunctionCoefficients &BFC, int orbital, double r_sq) | QMCBasisFunction | [private, static] |
| radialFunctionFirstDerivative(QMCBasisFunctionCoefficients &BFC, int orbital, double r_sq) | QMCBasisFunction | [private, static] |
| RadialFunctionFirstDerivativeInterpolation | QMCBasisFunction | [private] |
| RadialFunctionInterpolation | QMCBasisFunction | [private] |
| radialFunctionSecondDerivative(QMCBasisFunctionCoefficients &BFC, int orbital, double r_sq) | QMCBasisFunction | [private, static] |
| RadialFunctionSecondDerivativeInterpolation | QMCBasisFunction | [private] |
| read(string runfile) | QMCBasisFunction | |
| use_radial_interpolation | QMCBasisFunction | [private] |
| Xcalc | QMCBasisFunction | [protected] |
