| sc::canonical_aabb(3) | MPQC | sc::canonical_aabb(3) |
sc::canonical_aabb - If the shell loop structure has 2 fold symmetry between the first two indices and a 2 fold symmetry between the last two indices, then this should be used as the template argument to GPetite4.
#include <gpetite.h>
canonical_aabb (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)
If the shell loop structure has 2 fold symmetry between the first two indices and a 2 fold symmetry between the last two indices, then this should be used as the template argument to GPetite4.
Generated automatically by Doxygen for MPQC from the source code.
| Sun Oct 4 2020 | Version 2.3.1 |