29#ifndef _chemistry_qc_mbpt_csgrade12_h
30#define _chemistry_qc_mbpt_csgrade12_h
36#include <util/misc/regtime.h>
37#include <util/group/memory.h>
38#include <util/group/thread.h>
39#include <chemistry/qc/basis/integral.h>
40#include <chemistry/qc/basis/distshpair.h>
44#define PRINT_BIGGEST_INTS 0
46class CSGradErep12Qtr:
public Thread {
66 double print_percent_;
70 CSGradErep12Qtr(
int mythread_a,
int nthread_a,
71 int me_a,
int nproc_a,
78 double **scf_vector_a,
79 double tol_a,
int debug_a,
80 int dynamic_a,
double print_percent_a,
85 void set_i_offset(
int ioff) { i_offset = ioff; }
86 void set_ni(
int nivalue) { ni = nivalue; }
void run()
This is called with the Thread is run from a ThreadGrp.
This is used to store data that must be shared between all cooperating shell pairs.
Definition distshpair.h:52
A template class that maintains references counts.
Definition ref.h:332