2015-04-10 19:32:35 +02:00
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===========
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MRCC Module
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===========
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2015-04-02 10:13:33 +02:00
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2015-07-13 18:00:38 +02:00
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MRCC as a coupled cluster on a CAS+SD wave function.
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2015-04-10 19:32:35 +02:00
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Needed Modules
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==============
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2015-04-01 13:23:02 +02:00
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2015-04-13 10:44:49 +02:00
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.. Do not edit this section. It was auto-generated from the
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2015-06-04 12:09:28 +02:00
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.. 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_full <http://github.com/LCPQ/quantum_package/tree/master/src/Generators_full>`_
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2015-07-13 18:05:19 +02:00
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* `Psiref_CAS <http://github.com/LCPQ/quantum_package/tree/master/src/Psiref_CAS>`_
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2015-09-08 15:29:05 +02:00
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* `MRCC_Utils <http://github.com/LCPQ/quantum_package/tree/master/src/MRCC_Utils>`_
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2015-04-13 10:44:49 +02:00
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2015-04-10 19:32:35 +02:00
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Documentation
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=============
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2015-04-13 10:44:49 +02:00
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.. Do not edit this section. It was auto-generated from the
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2015-06-04 12:09:28 +02:00
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.. by the `update_README.py` script.
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2015-07-14 00:19:45 +02:00
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`mrcc <http://github.com/LCPQ/quantum_package/tree/master/src/MRCC_CASSD/mrcc_cassd.irp.f#L1>`_
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2015-06-04 12:09:28 +02:00
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Undocumented
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2015-04-13 10:44:49 +02:00
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2015-07-14 00:19:45 +02:00
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`print_cas_coefs <http://github.com/LCPQ/quantum_package/tree/master/src/MRCC_CASSD/mrcc_cassd.irp.f#L11>`_
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2015-06-04 12:09:28 +02:00
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Undocumented
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2015-04-13 10:44:49 +02:00
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2015-09-11 15:30:44 +02:00
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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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* `Perturbation <http://github.com/LCPQ/quantum_package/tree/master/plugins/Perturbation>`_
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* `Selectors_full <http://github.com/LCPQ/quantum_package/tree/master/plugins/Selectors_full>`_
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* `Generators_full <http://github.com/LCPQ/quantum_package/tree/master/plugins/Generators_full>`_
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* `Psiref_CAS <http://github.com/LCPQ/quantum_package/tree/master/plugins/Psiref_CAS>`_
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* `MRCC_Utils <http://github.com/LCPQ/quantum_package/tree/master/plugins/MRCC_Utils>`_
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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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`mrcc <http://github.com/LCPQ/quantum_package/tree/master/plugins/MRCC_CASSD/mrcc_cassd.irp.f#L1>`_
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Undocumented
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`print_cas_coefs <http://github.com/LCPQ/quantum_package/tree/master/plugins/MRCC_CASSD/mrcc_cassd.irp.f#L11>`_
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Undocumented
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