Atoms Member List

This is the complete list of members for Atoms, including all inherited members.

Atoms(const Vec *p, int n, SuperCell *s)	Atoms
counter	Atoms	protected
GetAtomicNumbers() const	Atoms	inlinevirtual
GetAtomicNumbersPtr()	Atoms	inline
GetCartesianPositions(Vec *p) const	Atoms	virtual
GetCartesianPositions() const	Atoms	inlinevirtual
GetChangeCounter() const	Atoms	inline
GetListOfElements(set< int > &elements) const	Atoms	virtual
GetNumberOfAtoms() const	Atoms	inlinevirtual
GetNumberOfImages() const	Atoms	inline
GetNumberOfRealAtoms() const	Atoms	inline
GetPositionsPtr()	Atoms	inline
GetPotential() const	Atoms	inline
GetSuperCell() const	Atoms	inlinevirtual
GetUnitCell() const	Atoms	virtual
GetUnwrappedPositions(vector< Vec > &p) const	Atoms	virtual
MarkChanged()	Atoms	inline
nAtoms	Atoms	protected
nImages	Atoms	protected
NormalizeDifference(Vec &diff) const	Atoms	virtual
NormalizeDifferences(Vec *diff) const	Atoms	virtual
NormalizePosition(Vec &pos) const	Atoms	virtual
NormalizePosition(Vec &pos, Vec &scaled_translation) const	Atoms	virtual
NormalizePositions()	Atoms	virtual
pos_translations	Atoms	protected
positions	Atoms	protected
potential	Atoms	protected
ReNormalizePosition(Vec &pos, Vec &scaled_translation) const	Atoms	virtual
SetAtomicNumbers(const int *z)	Atoms	virtual
SetCalculator(AsapPotential *potential)	Atoms	virtual
SetCartesianPositions(const Vec *p)	Atoms	virtual
SetNumberOfAtoms(int n)	Atoms	virtual
SetNumberOfImages(int i)	Atoms
SetUnitCell(const Vec newbasis[3], bool fix)	Atoms	virtual
SetUnwrappedPositions(const Vec *p)	Atoms	virtual
superCell	Atoms	protected
types	Atoms	protected
~Atoms()	Atoms	inlinevirtual