29 #ifndef _chemistry_qc_mbpt_csgrads2pdm_h
30 #define _chemistry_qc_mbpt_csgrads2pdm_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>
43 #define PRINT_BIGGEST_INTS 0
63 void accum_contrib(
double **sum,
double **contribs);
66 int me_a,
int nproc_a,
70 const double *PHF_a,
const double *P2AO_a,
71 int tol_a,
int debug_a,
int dynamic_a);
74 void accum_mp2_contrib(
double **ginter);
75 void accum_hf_contrib(
double **hf_ginter);
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