occ::qm::guess::SubshellOccupation Struct Reference

One subshell of a neutral atom's minimal-basis configuration. More...

#include <guess_density.h>

Public Attributes
int	n {0}
	principal quantum number
int	l {0}
	angular momentum
double	electrons {0}
	electrons in the whole subshell

Detailed Description

One subshell of a neutral atom's minimal-basis configuration.

Member Data Documentation

electrons

double occ::qm::guess::SubshellOccupation::electrons {0}

electrons in the whole subshell

l

int occ::qm::guess::SubshellOccupation::l {0}

angular momentum

n

int occ::qm::guess::SubshellOccupation::n {0}

principal quantum number

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

• /home/runner/work/occ/occ/include/occ/qm/guess_density.h