#include <eigsolver.h>
◆ funcT
template<typename T , int NDIM>
◆ EigSolverOp()
template<typename T , int NDIM>
◆ ~EigSolverOp()
template<typename T , int NDIM>
◆ coeff()
template<typename T , int NDIM>
◆ is_od()
template<typename T , int NDIM>
Is there an orbitally-dependent term?
Implemented in NuclearChargeDensityOp< T, NDIM >, madness::HartreeFockExchangeOp< T, NDIM >, madness::HartreeFockCoulombOp< T, NDIM >, madness::HartreeFockNuclearPotentialOp< T, NDIM >, madness::DFTNuclearChargeDensityOp< T, NDIM >, madness::XCFunctionalLDA< T, NDIM >, madness::DFTCoulombPeriodicOp< T, NDIM >, madness::DFTCoulombOp< T, NDIM >, and madness::DFTNuclearPotentialOp< T, NDIM >.
◆ is_rd()
template<typename T , int NDIM>
Is there a density-dependent term?
Implemented in NuclearChargeDensityOp< T, NDIM >, madness::HartreeFockExchangeOp< T, NDIM >, madness::HartreeFockCoulombOp< T, NDIM >, madness::HartreeFockNuclearPotentialOp< T, NDIM >, madness::DFTNuclearChargeDensityOp< T, NDIM >, madness::XCFunctionalLDA< T, NDIM >, madness::DFTCoulombPeriodicOp< T, NDIM >, madness::DFTCoulombOp< T, NDIM >, and madness::DFTNuclearPotentialOp< T, NDIM >.
◆ messageME()
template<typename T , int NDIM>
References madness::EigSolverOp< T, NDIM >::_messageME.
Referenced by madness::DFTCoulombOp< T, NDIM >::DFTCoulombOp(), madness::DFTCoulombPeriodicOp< T, NDIM >::DFTCoulombPeriodicOp(), madness::DFTNuclearChargeDensityOp< T, NDIM >::DFTNuclearChargeDensityOp(), madness::DFTNuclearPotentialOp< T, NDIM >::DFTNuclearPotentialOp(), madness::HartreeFockCoulombOp< T, NDIM >::HartreeFockCoulombOp(), madness::HartreeFockExchangeOp< T, NDIM >::HartreeFockExchangeOp(), madness::HartreeFockNuclearPotentialOp< T, NDIM >::HartreeFockNuclearPotentialOp(), and madness::XCFunctionalLDA< T, NDIM >::XCFunctionalLDA().
◆ messsageME()
template<typename T , int NDIM>
◆ multi_op_o()
template<typename T , int NDIM>
◆ multi_op_r()
template<typename T , int NDIM>
◆ op_o()
template<typename T , int NDIM>
◆ op_r()
template<typename T , int NDIM>
Density-dependent portion of operator.
Reimplemented in NuclearChargeDensityOp< T, NDIM >, madness::DFTNuclearChargeDensityOp< T, NDIM >, madness::XCFunctionalLDA< T, NDIM >, madness::DFTCoulombPeriodicOp< T, NDIM >, madness::DFTCoulombOp< T, NDIM >, and madness::DFTNuclearPotentialOp< T, NDIM >.
References madness::EigSolverOp< T, NDIM >::_world, and madness::func().
Referenced by madness::EigSolverOp< T, NDIM >::multi_op_r().
◆ prepare_op()
template<typename T , int NDIM>
Build the potential from a density if a density-dependent operator.
◆ thresh()
template<typename T , int NDIM>
◆ _coeff
template<typename T , int NDIM>
◆ _messageME
template<typename T , int NDIM>
◆ _thresh
template<typename T , int NDIM>
◆ _world
template<typename T , int NDIM>
The documentation for this class was generated from the following file: