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37 lines
560 B
ReStructuredText
37 lines
560 B
ReStructuredText
.. _write_integrals_erf:
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.. program:: write_integrals_erf
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===================
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write_integrals_erf
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===================
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Saves the two-electron integrals with the $erf(\mu r_{12})/r_{12}$
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oprerator into the EZFIO directory.
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Needs:
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.. hlist::
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:columns: 3
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* :c:data:`io_mo_two_e_integrals`
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* :c:data:`io_ao_two_e_integrals`
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Calls:
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.. hlist::
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:columns: 3
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* :c:func:`routine`
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Touches:
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.. hlist::
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:columns: 3
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* :c:data:`io_ao_two_e_integrals`
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* :c:data:`io_mo_two_e_integrals`
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