Nwc sym #1041
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Nwc sym #1041
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@lachlanbelcher thanks for the contribution |
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I will rebase this branch before merging |
…f symmetry adaptation for Columbus. So far, this is the calculation of the AO to SO matrix.
…ds abelian symmetry; currenty only identifies the linear combinations that make up the symmetry orbitals, but does not implement. CONTINUE TO USE ONLY C1 SYMMETRY!
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Corrected indexing problem with dipole integrals. Began process of adding abelian symmetry for Columbus -- calculates the symmetry orbitals but does not yet implement them. Continue using C1.