MPQC  2.3.1
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sc::canonical_aabc Class Reference

If the shell loop structure has 2 fold symmetry between the first two indices, then this should be used as the template argument to GPetite4. More...

#include <gpetite.h>

Public Member Functions

 canonical_aabc (const Ref< GaussianBasisSet > bi, const Ref< GaussianBasisSet > bj, const Ref< GaussianBasisSet > bk, const Ref< GaussianBasisSet > bl)
 
sc_int_least64_t offset (int i, int j, int k, int l)
 

Detailed Description

If the shell loop structure has 2 fold symmetry between the first two indices, then this should be used as the template argument to GPetite4.


The documentation for this class was generated from the following file:

Generated at Sun Jan 26 2020 23:33:05 for MPQC 2.3.1 using the documentation package Doxygen 1.8.16.