sc_CSGradS2PDM man page
sc::CSGradS2PDM — Inherits sc::Thread. Generated automatically by Doxygen for MPQC from the source code.
Public Member Functions
CSGradS2PDM (int mythread_a, int nthread_a, int me_a, int nproc_a, const Ref< ThreadLock > &lock_a, const Ref< GaussianBasisSet > &basis_a, const Ref< TwoBodyDerivInt > &tbintder_a, const double *PHF_a, const double *P2AO_a, int tol_a, int debug_a, int dynamic_a)
void accum_mp2_contrib (double **ginter)
void accum_hf_contrib (double **hf_ginter)
void run ()
This is called with the Thread is run from a ThreadGrp.
Additional Inherited Members
Generated automatically by Doxygen for MPQC from the source code.