sc::CSGrad34Qbtr(3) MPQC sc::CSGrad34Qbtr(3)NAME
sc::CSGrad34Qbtr -
SYNOPSIS
Inherits sc::Thread.
Public Member Functions
CSGrad34Qbtr (int mythread_a, int nthread_a, int me_a, int nproc_a,
const Ref< MemoryGrp > &mem_a, const Ref< MessageGrp > &msg_a,
const Ref< ThreadLock > &lock_a, const Ref< GaussianBasisSet >
&basis_a, const Ref< TwoBodyInt > &tbint_a, const Ref<
TwoBodyDerivInt > &tbintder_a, int nocc_a, int nfzc_a, double
**scf_vector_a, double tol_a, int debug_a, int dynamic_a, double
print_percent_a, DistShellPair::SharedData *shellpair_shared_data,
int dograd_a, int natom_a)
void set_i_offset (int ioff)
void set_ni (int nivalue)
void run ()
This is called with the Thread is run from a ThreadGrp.
double * get_Lpi ()
double ** get_ginter ()
int get_aointder_computed ()
Additional Inherited Members
Author
Generated automatically by Doxygen for MPQC from the source code.
Version 2.3.1 Fri Feb 19 2016 sc::CSGrad34Qbtr(3)
