votca::xtp::ChargeResponseSolver::Coupling Struct Reference

Public Attributes
bool	skip = false
Eigen::Matrix3d	T
bool	charges = false
Eigen::Vector3d	r
double	B0 = 0.0
double	B1 = 0.0

Detailed Description

Definition at line 99 of file chargeresponsesolver.h.

Member Data Documentation

B0

double votca::xtp::ChargeResponseSolver::Coupling::B0 = 0.0

Definition at line 104 of file chargeresponsesolver.h.

B1

double votca::xtp::ChargeResponseSolver::Coupling::B1 = 0.0

Definition at line 105 of file chargeresponsesolver.h.

charges

bool votca::xtp::ChargeResponseSolver::Coupling::charges = false

Definition at line 102 of file chargeresponsesolver.h.

r

Eigen::Vector3d votca::xtp::ChargeResponseSolver::Coupling::r

Definition at line 103 of file chargeresponsesolver.h.

skip

bool votca::xtp::ChargeResponseSolver::Coupling::skip = false

Definition at line 100 of file chargeresponsesolver.h.

T

Eigen::Matrix3d votca::xtp::ChargeResponseSolver::Coupling::T

Definition at line 101 of file chargeresponsesolver.h.

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

• xtp/include/votca/xtp/chargeresponsesolver.h