ElecGradient Struct Reference

Vector space entry for electronic minimization. More...

#include <ElecMinimizer.h>

Public Member Functions
void	init (const Everything &e)
	initialize C and Haux with the correct sizes for everything
ElecGradient &	operator*= (double alpha)
	scalar multiply

Public Attributes
std::vector< ColumnBundle >	C
	wavefunctions
std::vector< matrix >	Haux
	auxiliary Hamiltonian
const ElecInfo *	eInfo

Detailed Description

Vector space entry for electronic minimization.

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

• electronic/ElecMinimizer.h