Inheritance diagram for Scine::Sparrow::DFTBMethodWrapper:

Collaboration diagram for Scine::Sparrow::DFTBMethodWrapper:

Public Member Functions
	DFTBMethodWrapper ()
	Constructor. It plays with the befriended states handler by giving it a *this reference.

Utils::PropertyList	possibleProperties () const final
	Get the list of the possible properties to calculate analytically. Since it is the same for all DFTB, have it stated here. If they diverge, override this in each method wrapper.

TDDFTBData	getTDDFTBData () const

bool	allowsPythonGILRelease () const override
	Whether the calculator has no underlying Python code and can therefore release the global interpreter lock in Python bindings.

Public Member Functions inherited from Scine::Utils::CloneInterface< Utils::Abstract< DFTBMethodWrapper >, GenericMethodWrapper, Core::Calculator >
std::shared_ptr < Utils::Abstract < DFTBMethodWrapper > >	clone () const

Protected Member Functions
virtual TDDFTBData	getTDDFTBDataImpl () const =0

template<class DFTBMethod >
void	copyInto (DFTBMethod &instance, const DFTBMethod &classToCopy)

bool	getZPVEInclusion () const final

The documentation for this class was generated from the following files:

Public Member Functions

Protected Member Functions