28#ifndef _chemistry_qc_scf_tbgrad_h
29#define _chemistry_qc_scf_tbgrad_h
35#include <util/group/thread.h>
43 double exchange_fraction;
49 inline void set_scale(
double& coulombscale,
double& exchangescale,
50 int i,
int j,
int k,
int l)
const
60 coulombscale = 0.5*scale;
61 exchangescale = -0.25*scale * exchange_fraction;
The Thread abstract class defines an interface which must be implemented by classes wishing to be run...
Definition: thread.h:79