nnp::SymFncBaseCutoff Member List

This is the complete list of members for nnp::SymFncBaseCutoff, including all inherited members.

addCacheIndex(std::size_t element, std::size_t cacheIndex, std::string cacheIdentifier)	nnp::SymFnc
cacheIndices	nnp::SymFnc	protected
calculate(Atom &atom, bool const derivatives) const =0	nnp::SymFnc	pure virtual
calculateAngularPart(double angle) const =0	nnp::SymFnc	pure virtual
calculateRadialPart(double distance) const =0	nnp::SymFnc	pure virtual
changeLengthUnit(double convLength)=0	nnp::SymFnc	pure virtual
checkRelevantElement(std::size_t index) const =0	nnp::SymFnc	pure virtual
convLength	nnp::SymFnc	protected
cutoffAlpha	nnp::SymFncBaseCutoff	protected
cutoffType	nnp::SymFncBaseCutoff	protected
ec	nnp::SymFnc	protected
elementMap	nnp::SymFnc	protected
fc	nnp::SymFncBaseCutoff	protected
getCacheIdentifiers() const	nnp::SymFnc	virtual
getCacheIndices() const	nnp::SymFnc	inline
getConvLength() const	nnp::SymFnc	inline
getCutoffAlpha() const	nnp::SymFncBaseCutoff	inline
getCutoffType() const	nnp::SymFncBaseCutoff	inline
getEc() const	nnp::SymFnc	inline
getGmax() const	nnp::SymFnc	inline
getGmin() const	nnp::SymFnc	inline
getIndex() const	nnp::SymFnc	inline
getIndexPerElement() const	nnp::SymFnc	inline
getLineNumber() const	nnp::SymFnc	inline
getMinNeighbors() const	nnp::SymFnc	inline
getParameters() const	nnp::SymFnc	inline
getPrintFormat() const	nnp::SymFnc	protected
getRc() const	nnp::SymFnc	inline
getScalingFactor() const	nnp::SymFnc	inline
getSettingsLine() const =0	nnp::SymFnc	pure virtual
getSubtype() const	nnp::SymFncBaseCutoff	inline
getType() const	nnp::SymFnc	inline
Gmax	nnp::SymFnc	protected
Gmean	nnp::SymFnc	protected
Gmin	nnp::SymFnc	protected
Gsigma	nnp::SymFnc	protected
index	nnp::SymFnc	protected
indexPerElement	nnp::SymFnc	protected
initializePrintFormat()	nnp::SymFnc	protectedstatic
initializePrintOrder()	nnp::SymFnc	protectedstatic
lineNumber	nnp::SymFnc	protected
minNeighbors	nnp::SymFnc	protected
operator!=(SymFnc const &rhs) const	nnp::SymFnc	inline
operator<(SymFnc const &rhs) const =0	nnp::SymFnc	pure virtual
operator<=(SymFnc const &rhs) const	nnp::SymFnc	inline
operator==(SymFnc const &rhs) const =0	nnp::SymFnc	pure virtual
operator>(SymFnc const &rhs) const	nnp::SymFnc	inline
operator>=(SymFnc const &rhs) const	nnp::SymFnc	inline
parameterInfo() const	nnp::SymFncBaseCutoff	virtual
parameterLine() const =0	nnp::SymFnc	pure virtual
parameters	nnp::SymFnc	protected
PrintFormat typedef	nnp::SymFnc	protected
printFormat	nnp::SymFnc	protectedstatic
PrintOrder typedef	nnp::SymFnc	protected
printOrder	nnp::SymFnc	protectedstatic
rc	nnp::SymFnc	protected
scale(double value) const	nnp::SymFnc
scalingFactor	nnp::SymFnc	protected
scalingLine() const	nnp::SymFnc
ScalingType enum name	nnp::SymFnc
scalingType	nnp::SymFnc	protected
setCutoffFunction(CutoffFunction::CutoffType cutoffType, double cutoffAlpha)	nnp::SymFncBaseCutoff
setIndex(std::size_t index)	nnp::SymFnc	inline
setIndexPerElement(std::size_t elementIndex, std::size_t index)	nnp::SymFnc	inline
setLineNumber(std::size_t lineNumber)	nnp::SymFnc	inline
setParameters(std::string const &parameterString)=0	nnp::SymFnc	pure virtual
setScalingType(ScalingType scalingType, std::string statisticsLine, double Smin, double Smax)	nnp::SymFnc
sfinfoWidth	nnp::SymFnc	protectedstatic
Smax	nnp::SymFnc	protected
Smin	nnp::SymFnc	protected
ST_CENTER enum value	nnp::SymFnc
ST_NONE enum value	nnp::SymFnc
ST_SCALE enum value	nnp::SymFnc
ST_SCALECENTER enum value	nnp::SymFnc
ST_SCALESIGMA enum value	nnp::SymFnc
subtype	nnp::SymFncBaseCutoff	protected
SymFnc(std::size_t type, ElementMap const &)	nnp::SymFnc	protected
SymFncBaseCutoff(std::size_t type, ElementMap const &)	nnp::SymFncBaseCutoff	protected
type	nnp::SymFnc	protected
unscale(double value) const	nnp::SymFnc
~SymFnc()	nnp::SymFnc	inlinevirtual