occ
|
#include <point_functors.h>
Public Member Functions | |
DeformationDensityFunctor (const Wavefunction &wfn, SpinConstraint=SpinConstraint::Total) | |
void | operator() (Eigen::Ref< const Mat3N > points, Eigen::Ref< Vec > dest) |
Public Attributes | |
PromolDensityFunctor | pro_func |
ElectronDensityFunctor | rho_func |
occ::main::DeformationDensityFunctor::DeformationDensityFunctor | ( | const Wavefunction & | wfn, |
SpinConstraint | = SpinConstraint::Total |
||
) |
void occ::main::DeformationDensityFunctor::operator() | ( | Eigen::Ref< const Mat3N > | points, |
Eigen::Ref< Vec > | dest | ||
) |
PromolDensityFunctor occ::main::DeformationDensityFunctor::pro_func |
ElectronDensityFunctor occ::main::DeformationDensityFunctor::rho_func |