Public Member Functions
	OrbitalDesc (int l=0, int m=0, int s=0, SpinType spinType=SpinNone)

void	parse (string desc)
	set values from a string (throws a string exception on invalid input)

	operator string () const
	convert to a string description

bool	operator< (const OrbitalDesc &) const
	so that OrbitalDesc can be used as a key

Public Attributes
int	l

int	m

int	s

unsigned	n
	pseudo-atom quantum numbers (m = l+1 is used to signify total l-contribution)

SpinType	spinType
	SpinOrbit => relativistic spec, SpinZ => Up/Dn, SpinNone => no spin (collinear) (Note different meanings from eInfo.spinType)

The documentation for this struct was generated from the following file:

Public Member Functions

Public Attributes