2015-03-24 19:41:56 +01:00
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======================
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CAS_SD_selected Module
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======================
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2015-04-09 21:46:28 +02:00
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Selected CAS + SD module.
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1) Set the different MO classes using the ``qp_set_mo_class`` command
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2) Run the selected CAS+SD program
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2015-04-13 10:44:49 +02:00
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Documentation
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=============
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.. Do not edit this section. It was auto-generated from the
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2015-05-26 17:40:39 +02:00
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.. NEEDED_MODULES_CHILDREN file by the `update_README.py` script.
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2015-04-13 10:44:49 +02:00
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`full_ci <http://github.com/LCPQ/quantum_package/tree/master/src/CAS_SD/cas_sd_selected.irp.f#L1>`_
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Undocumented
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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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2015-05-26 17:40:39 +02:00
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.. NEEDED_MODULES_CHILDREN file by the `update_README.py` script.
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2015-04-13 10:44:49 +02:00
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2015-06-02 18:17:59 +02:00
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.. image:: tree_dependency.png
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2015-05-12 10:39:49 +02:00
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2015-04-13 10:44:49 +02:00
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* `Perturbation <http://github.com/LCPQ/quantum_package/tree/master/src/Perturbation>`_
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* `Selectors_full <http://github.com/LCPQ/quantum_package/tree/master/src/Selectors_full>`_
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2015-04-30 17:36:36 +02:00
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* `Generators_CAS <http://github.com/LCPQ/quantum_package/tree/master/src/Generators_CAS>`_
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2015-04-13 10:44:49 +02:00
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