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29 lines
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29 lines
1.2 KiB
ReStructuredText
=============
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BiInts Module
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=============
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Here, all bi-electronic integrals (:math:`1/r_{12}`) are computed. As they have
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4 indices and many are zero, they are stored in a map, as defined in
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``Utils/map_module.f90``. To fetch an AO integral, use the
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``get_ao_bielec_integral(i,j,k,l,ao_integrals_map)`` function, and to fetch and
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MO integral, use ``get_mo_bielec_integral(i,j,k,l,mo_integrals_map)`` or
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``mo_bielec_integral(i,j,k,l)``.
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Needed Modules
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==============
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.. Do not edit this section. It was auto-generated from the
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.. NEEDED_MODULES file.
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* `AOs <http://github.com/LCPQ/quantum_package/tree/master/src/AOs>`_
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* `Bitmask <http://github.com/LCPQ/quantum_package/tree/master/src/Bitmask>`_
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* `Electrons <http://github.com/LCPQ/quantum_package/tree/master/src/Electrons>`_
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* `Ezfio_files <http://github.com/LCPQ/quantum_package/tree/master/src/Ezfio_files>`_
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* `MOs <http://github.com/LCPQ/quantum_package/tree/master/src/MOs>`_
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* `Nuclei <http://github.com/LCPQ/quantum_package/tree/master/src/Nuclei>`_
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* `Output <http://github.com/LCPQ/quantum_package/tree/master/src/Output>`_
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* `Utils <http://github.com/LCPQ/quantum_package/tree/master/src/Utils>`_
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* `MonoInts <http://github.com/LCPQ/quantum_package/tree/master/src/MonoInts>`_
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