votca 2026-dev
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votca::xtp::qp_solver::RootCandidate Struct Reference

#include <qp_solver_utils.h>

Public Attributes

double omega = 0.0
double residual = 0.0
double deriv = 0.0
double Z = 0.0
double distance_to_ref = 0.0
bool accepted = false

Detailed Description

Definition at line 66 of file qp_solver_utils.h.

Member Data Documentation

◆ accepted

bool votca::xtp::qp_solver::RootCandidate::accepted = false

Definition at line 72 of file qp_solver_utils.h.

◆ deriv

double votca::xtp::qp_solver::RootCandidate::deriv = 0.0

Definition at line 69 of file qp_solver_utils.h.

◆ distance_to_ref

double votca::xtp::qp_solver::RootCandidate::distance_to_ref = 0.0

Definition at line 71 of file qp_solver_utils.h.

◆ omega

double votca::xtp::qp_solver::RootCandidate::omega = 0.0

Definition at line 67 of file qp_solver_utils.h.

◆ residual

double votca::xtp::qp_solver::RootCandidate::residual = 0.0

Definition at line 68 of file qp_solver_utils.h.

◆ Z

double votca::xtp::qp_solver::RootCandidate::Z = 0.0

Definition at line 70 of file qp_solver_utils.h.


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