votca 2026-dev
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votca::xtp::BSE_UKS::options Struct Reference

#include <bse_uks.h>

Collaboration diagram for votca::xtp::BSE_UKS::options:

Public Attributes

bool useTDA
Index rpamin
Index rpamax
Index qpmin
Index qpmax
Index vmin
Index cmax
Index nmax
std::string davidson_correction
std::string davidson_tolerance
std::string davidson_update
Index davidson_maxiter
double min_print_weight
bool use_Hqp_offdiag
Index max_dyn_iter
double dyn_tolerance

Detailed Description

Definition at line 36 of file bse_uks.h.

Member Data Documentation

◆ cmax

Index votca::xtp::BSE_UKS::options::cmax

Definition at line 43 of file bse_uks.h.

◆ davidson_correction

std::string votca::xtp::BSE_UKS::options::davidson_correction

Definition at line 45 of file bse_uks.h.

◆ davidson_maxiter

Index votca::xtp::BSE_UKS::options::davidson_maxiter

Definition at line 48 of file bse_uks.h.

◆ davidson_tolerance

std::string votca::xtp::BSE_UKS::options::davidson_tolerance

Definition at line 46 of file bse_uks.h.

◆ davidson_update

std::string votca::xtp::BSE_UKS::options::davidson_update

Definition at line 47 of file bse_uks.h.

◆ dyn_tolerance

double votca::xtp::BSE_UKS::options::dyn_tolerance

Definition at line 52 of file bse_uks.h.

◆ max_dyn_iter

Index votca::xtp::BSE_UKS::options::max_dyn_iter

Definition at line 51 of file bse_uks.h.

◆ min_print_weight

double votca::xtp::BSE_UKS::options::min_print_weight

Definition at line 49 of file bse_uks.h.

◆ nmax

Index votca::xtp::BSE_UKS::options::nmax

Definition at line 44 of file bse_uks.h.

◆ qpmax

Index votca::xtp::BSE_UKS::options::qpmax

Definition at line 41 of file bse_uks.h.

◆ qpmin

Index votca::xtp::BSE_UKS::options::qpmin

Definition at line 40 of file bse_uks.h.

◆ rpamax

Index votca::xtp::BSE_UKS::options::rpamax

Definition at line 39 of file bse_uks.h.

◆ rpamin

Index votca::xtp::BSE_UKS::options::rpamin

Definition at line 38 of file bse_uks.h.

◆ use_Hqp_offdiag

bool votca::xtp::BSE_UKS::options::use_Hqp_offdiag

Definition at line 50 of file bse_uks.h.

◆ useTDA

bool votca::xtp::BSE_UKS::options::useTDA

Definition at line 37 of file bse_uks.h.

◆ vmin

Index votca::xtp::BSE_UKS::options::vmin

Definition at line 42 of file bse_uks.h.


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