Electronic energy components. More...

#include <Energies.h>

Public Member Functions
double	F () const
	Helmholtz energy (Etot-TS)

double	G () const
	Grand free energy (F-muN)

	Energies ()
	initialize all to 0.

void	print (FILE *fp=globalLog) const
	print energies to logPrintf / stream

Public Attributes
EnergyComponents	E
	All components of the internal energy (excluding TS and muN)

double	TS
	Fillings entropy.

double	muN
	Fixed electron chemical potential Lagrange multiplier.

double	Eband
	band structure energy (tr Hsub)

Detailed Description

Electronic energy components.

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

Public Member Functions