votca::xtp::PolarRegion Member List

This is the complete list of members for votca::xtp::PolarRegion, including all inherited members.

AddResults(tools::Property &prop) const	votca::xtp::Region
AppendResult(tools::Property &prop) const override	votca::xtp::PolarRegion	protectedvirtual
ApplyInfluenceOfOtherRegions(std::vector< std::unique_ptr< Region > > &regions)	votca::xtp::Region	protected
begin()	votca::xtp::MMRegion< PolarSegment >	inline
begin() const	votca::xtp::MMRegion< PolarSegment >	inline
CalcInducedDipoleInsideSegments() const	votca::xtp::PolarRegion	private
CalcInducedDipoles()	votca::xtp::PolarRegion	private
CalcInducedDipolesViaPCG(const Eigen::VectorXd &initial_guess)	votca::xtp::PolarRegion	private
CalcPolDoF() const	votca::xtp::PolarRegion	private
charge() const override	votca::xtp::MMRegion< PolarSegment >	virtual
Converged() const override	votca::xtp::PolarRegion	virtual
deltaD_	votca::xtp::PolarRegion	private
deltaE_	votca::xtp::PolarRegion	private
E_hist_	votca::xtp::PolarRegion	private
end()	votca::xtp::MMRegion< PolarSegment >	inline
end() const	votca::xtp::MMRegion< PolarSegment >	inline
ErrorMsg() const	votca::xtp::Region	inline
errormsg_	votca::xtp::Region	protected
Etotal() const override	votca::xtp::PolarRegion	inlinevirtual
Evaluate(std::vector< std::unique_ptr< Region > > &regions) override	votca::xtp::PolarRegion	virtual
exp_damp_	votca::xtp::PolarRegion	private
getId() const	votca::xtp::Region	inline
id_	votca::xtp::Region	protected
identify() const override	votca::xtp::PolarRegion	inlinevirtual
info_	votca::xtp::Region	protected
Initialize(const tools::Property &prop) override	votca::xtp::PolarRegion	virtual
InteractwithPolarRegion(const PolarRegion &region) override	votca::xtp::PolarRegion	protectedvirtual
InteractwithQMRegion(const QMRegion &region) override	votca::xtp::PolarRegion	protectedvirtual
InteractwithStaticRegion(const StaticRegion &region) override	votca::xtp::PolarRegion	protectedvirtual
iterator typedef	votca::xtp::MMRegion< PolarSegment >
log_	votca::xtp::Region	protected
max_iter_	votca::xtp::PolarRegion	private
MMRegion(Index id, Logger &log)	votca::xtp::MMRegion< PolarSegment >	inline
operator[](Index index) const	votca::xtp::MMRegion< PolarSegment >	inline
operator[](Index index)	votca::xtp::MMRegion< PolarSegment >	inline
PolarEnergy() const	votca::xtp::PolarRegion	private
PolarEnergy_extern() const	votca::xtp::PolarRegion	private
PolarInteraction_scf()	votca::xtp::PolarRegion	private
PolarRegion(Index id, Logger &log)	votca::xtp::PolarRegion	inline
push_back(const PolarSegment &seg)	votca::xtp::MMRegion< PolarSegment >	inline
ReadFromCpt(CheckpointReader &r) override	votca::xtp::PolarRegion	virtual
ReadInducedDipolesFromLastIteration() const	votca::xtp::PolarRegion	private
Region(Index id, Logger &log)	votca::xtp::Region	inline
Reset() override	votca::xtp::PolarRegion	virtual
segments_	votca::xtp::MMRegion< PolarSegment >	protected
SegmentType typedef	votca::xtp::MMRegion< PolarSegment >
size() const override	votca::xtp::MMRegion< PolarSegment >	inlinevirtual
StaticInteraction()	votca::xtp::PolarRegion	private
Successful() const	votca::xtp::Region	inline
WriteInducedDipolesToSegments(const Eigen::VectorXd &x)	votca::xtp::PolarRegion	private
WritePDB(csg::PDBWriter &writer) const override	votca::xtp::MMRegion< PolarSegment >	virtual
WriteToCpt(CheckpointWriter &w) const override	votca::xtp::PolarRegion	virtual
~Region()=default	votca::xtp::Region	virtual