#include <gw.h>

Collaboration diagram for votca::xtp::GW::options:

[legend]

Public Attributes
Index	homo

Index	qpmin

Index	qpmax

Index	rpamin

Index	rpamax

double	eta

double	g_sc_limit

Index	g_sc_max_iterations

double	gw_sc_limit

Index	gw_sc_max_iterations

double	shift = 0

double	ScaHFX = 0.0

std::string	sigma_integration

Index	reset_3c

std::string	qp_solver

double	qp_solver_alpha = 0.75

Index	qp_grid_steps

double	qp_grid_spacing

Index	gw_mixing_order

double	gw_mixing_alpha

std::string	quadrature_scheme

Index	order

double	alpha

Detailed Description

Definition at line 44 of file gw.h.

Member Data Documentation

◆ alpha

double votca::xtp::GW::options::alpha

Definition at line 68 of file gw.h.

◆ eta

double votca::xtp::GW::options::eta

Definition at line 50 of file gw.h.

◆ g_sc_limit

double votca::xtp::GW::options::g_sc_limit

Definition at line 51 of file gw.h.

◆ g_sc_max_iterations

Index votca::xtp::GW::options::g_sc_max_iterations

Definition at line 52 of file gw.h.

◆ gw_mixing_alpha

double votca::xtp::GW::options::gw_mixing_alpha

Definition at line 65 of file gw.h.

◆ gw_mixing_order

Index votca::xtp::GW::options::gw_mixing_order

Definition at line 64 of file gw.h.

◆ gw_sc_limit

double votca::xtp::GW::options::gw_sc_limit

Definition at line 53 of file gw.h.

◆ gw_sc_max_iterations

Index votca::xtp::GW::options::gw_sc_max_iterations

Definition at line 54 of file gw.h.

◆ homo

Index votca::xtp::GW::options::homo

Definition at line 45 of file gw.h.

◆ order

Index votca::xtp::GW::options::order

Definition at line 67 of file gw.h.

◆ qp_grid_spacing

double votca::xtp::GW::options::qp_grid_spacing

Definition at line 63 of file gw.h.

◆ qp_grid_steps

Index votca::xtp::GW::options::qp_grid_steps

Definition at line 62 of file gw.h.

◆ qp_solver

std::string votca::xtp::GW::options::qp_solver

Definition at line 60 of file gw.h.

◆ qp_solver_alpha

double votca::xtp::GW::options::qp_solver_alpha = 0.75

Definition at line 61 of file gw.h.

◆ qpmax

Index votca::xtp::GW::options::qpmax

Definition at line 47 of file gw.h.

◆ qpmin

Index votca::xtp::GW::options::qpmin

Definition at line 46 of file gw.h.

◆ quadrature_scheme

std::string votca::xtp::GW::options::quadrature_scheme

Definition at line 66 of file gw.h.

◆ reset_3c

Index votca::xtp::GW::options::reset_3c

Definition at line 58 of file gw.h.

◆ rpamax

Index votca::xtp::GW::options::rpamax

Definition at line 49 of file gw.h.

◆ rpamin

Index votca::xtp::GW::options::rpamin

Definition at line 48 of file gw.h.

◆ ScaHFX

double votca::xtp::GW::options::ScaHFX = 0.0

Definition at line 56 of file gw.h.

◆ shift

double votca::xtp::GW::options::shift = 0

Definition at line 55 of file gw.h.

◆ sigma_integration

std::string votca::xtp::GW::options::sigma_integration

Definition at line 57 of file gw.h.

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

xtp/include/votca/xtp/gw.h

Public Attributes