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45 lines
1.3 KiB
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45 lines
1.3 KiB
ReStructuredText
Documentation
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=============
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.. Do not edit this section. It was auto-generated from the
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.. by the `update_README.py` script.
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`loc_rasorb <http://github.com/LCPQ/quantum_package/tree/master/src/loc_cele/loc_cele.irp.f#L1>`_
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This program performs a localization of the active orbitals
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of a CASSCF wavefunction, reading the orbitals from a RASORB
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file of molcas.
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id1=max is the number of MO in a given symmetry.
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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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.. by the `update_README.py` script.
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.. image:: tree_dependency.png
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* `MO_Basis <http://github.com/LCPQ/quantum_package/tree/master/src/MO_Basis>`_
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Needed Modules
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==============
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.. Do not edit this section It was auto-generated
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.. by the `update_README.py` script.
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.. image:: tree_dependency.png
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* `MO_Basis <http://github.com/LCPQ/quantum_package/tree/master/src/MO_Basis>`_
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Documentation
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=============
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.. Do not edit this section It was auto-generated
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.. by the `update_README.py` script.
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`loc_rasorb <http://github.com/LCPQ/quantum_package/tree/master/plugins/loc_cele/loc_cele.irp.f#L1>`_
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This program performs a localization of the active orbitals
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of a CASSCF wavefunction, reading the orbitals from a RASORB
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|
file of molcas.
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id1=max is the number of MO in a given symmetry.
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