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occ::dft::DFTMethod Struct Reference

#include <dft_method.h>

Public Member Functions

double exchange_factor () const
 
RangeSeparatedParameters range_separated_parameters () const
 

Public Attributes

std::vector< DensityFunctionalfunctionals
 
std::vector< DensityFunctionalfunctionals_polarized
 
std::string dispersion
 
std::string gcp
 
std::string basis_set
 

Member Function Documentation

◆ exchange_factor()

double occ::dft::DFTMethod::exchange_factor ( ) const

◆ range_separated_parameters()

RangeSeparatedParameters occ::dft::DFTMethod::range_separated_parameters ( ) const

Member Data Documentation

◆ basis_set

std::string occ::dft::DFTMethod::basis_set

◆ dispersion

std::string occ::dft::DFTMethod::dispersion

◆ functionals

std::vector<DensityFunctional> occ::dft::DFTMethod::functionals

◆ functionals_polarized

std::vector<DensityFunctional> occ::dft::DFTMethod::functionals_polarized

◆ gcp

std::string occ::dft::DFTMethod::gcp

The documentation for this struct was generated from the following file: