#include <core/ScalarFieldArray.h>
#include <core/Coulomb.h>

Classes
class	DumpSelfInteractionCorrection
	Output self-interaction correction for the KS eigenvalues. More...

struct	SlabEpsilon
	Slab dielectric function calculator. More...

struct	BulkEpsilon
	Bulk dielectric function calculator. More...

struct	ChargedDefect
	Charged defect correction calculator. More...

struct	ChargedDefect::Center
	Model charge decsription (one for each defect in unit cell) More...

struct	DumpCprime

Functions
void	dumpExcitations (const Everything &e, const char *filename)
	Dump information about excitation energies and matrix elements.

void	dumpFCI (const Everything &e, const char *filename)
	Dump coulomb matrix elements in FCIDUMP format.

void	dumpMoment (const Everything &e, const char *filename)
	Dump dipole moments.

ScalarFieldArray	XC_Analysis::tauWeizsacker (const Everything &e)
	Output Weizsacker KE density.

ScalarFieldArray	XC_Analysis::spness (const Everything &e)
	Output 'single-particle-ness'.

ScalarFieldArray	XC_Analysis::sHartree (const Everything &e)
	output spin Hartree potentials

void	dumpProjections (const Everything &e, const char *filename, bool ortho, bool norm)
	Dump band projections to atomic orbitals or ortho-orbitals depending on ortho, and complex or real based on norm.

Detailed Description

Implementation internals for output modules

Classes