Scine::Sparrow  5.0.0
Library for fast and agile quantum chemical calculations with semiempirical methods.
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Scine::Sparrow::nddo::PM6DiatomicParameters Member List

This is the complete list of members for Scine::Sparrow::nddo::PM6DiatomicParameters, including all inherited members.

alpha() const (defined in Scine::Sparrow::nddo::PM6DiatomicParameters)Scine::Sparrow::nddo::PM6DiatomicParametersinline
DiatomicParameters()=default (defined in Scine::Sparrow::nddo::DiatomicParameters)Scine::Sparrow::nddo::DiatomicParameters
firstElement() const (defined in Scine::Sparrow::nddo::DiatomicParameters)Scine::Sparrow::nddo::DiatomicParametersinline
isValid() const (defined in Scine::Sparrow::nddo::DiatomicParameters)Scine::Sparrow::nddo::DiatomicParametersinline
PM6DiatomicParameters(Utils::ElementType e1=Utils::ElementType::none, Utils::ElementType e2=Utils::ElementType::none) (defined in Scine::Sparrow::nddo::PM6DiatomicParameters)Scine::Sparrow::nddo::PM6DiatomicParametersinline
secondElement() const (defined in Scine::Sparrow::nddo::DiatomicParameters)Scine::Sparrow::nddo::DiatomicParametersinline
setAlpha(double a) (defined in Scine::Sparrow::nddo::PM6DiatomicParameters)Scine::Sparrow::nddo::PM6DiatomicParametersinline
setFirstElement(Utils::ElementType e) (defined in Scine::Sparrow::nddo::DiatomicParameters)Scine::Sparrow::nddo::DiatomicParametersinline
setSecondElement(Utils::ElementType e) (defined in Scine::Sparrow::nddo::DiatomicParameters)Scine::Sparrow::nddo::DiatomicParametersinline
setX(double x) (defined in Scine::Sparrow::nddo::PM6DiatomicParameters)Scine::Sparrow::nddo::PM6DiatomicParametersinline
x() const (defined in Scine::Sparrow::nddo::PM6DiatomicParameters)Scine::Sparrow::nddo::PM6DiatomicParametersinline
~DiatomicParameters()=default (defined in Scine::Sparrow::nddo::DiatomicParameters)Scine::Sparrow::nddo::DiatomicParametersvirtual