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mirror of https://github.com/LCPQ/quantum_package synced 2024-06-28 08:02:20 +02:00
quantum_package/src/Full_CI
2014-06-03 19:14:12 +02:00
..
ASSUMPTIONS.rst Corrected bugs 2014-05-28 23:12:00 +02:00
full_ci.irp.f Corrected bitmask bug for Multi-reference 2014-06-03 19:14:12 +02:00
H_apply.irp.f Corrected bitmask bug for Multi-reference 2014-06-03 19:14:12 +02:00
Makefile Corrected bugs 2014-05-28 23:12:00 +02:00
NEEDED_MODULES Corrected bugs 2014-05-28 23:12:00 +02:00
README.rst Updated FCI 2014-05-29 01:38:46 +02:00

==============
Full_CI Module
==============

Performs a perturbatively selected Full-CI.

Documentation
=============

.. Do not edit this section. It was auto-generated from the
.. NEEDED_MODULES file.

`cisd <http://github.com/LCPQ/quantum_package/tree/master/src/Full_CI/full_ci.irp.f#L1>`_
  Undocumented



Needed Modules
==============

.. Do not edit this section. It was auto-generated from the
.. NEEDED_MODULES file.

* `AOs <http://github.com/LCPQ/quantum_package/tree/master/src/AOs>`_
* `BiInts <http://github.com/LCPQ/quantum_package/tree/master/src/BiInts>`_
* `Bitmask <http://github.com/LCPQ/quantum_package/tree/master/src/Bitmask>`_
* `Dets <http://github.com/LCPQ/quantum_package/tree/master/src/Dets>`_
* `Electrons <http://github.com/LCPQ/quantum_package/tree/master/src/Electrons>`_
* `Ezfio_files <http://github.com/LCPQ/quantum_package/tree/master/src/Ezfio_files>`_
* `Generators_full <http://github.com/LCPQ/quantum_package/tree/master/src/Generators_full>`_
* `Hartree_Fock <http://github.com/LCPQ/quantum_package/tree/master/src/Hartree_Fock>`_
* `MonoInts <http://github.com/LCPQ/quantum_package/tree/master/src/MonoInts>`_
* `MOs <http://github.com/LCPQ/quantum_package/tree/master/src/MOs>`_
* `Nuclei <http://github.com/LCPQ/quantum_package/tree/master/src/Nuclei>`_
* `Output <http://github.com/LCPQ/quantum_package/tree/master/src/Output>`_
* `Selectors_full <http://github.com/LCPQ/quantum_package/tree/master/src/Selectors_full>`_
* `Utils <http://github.com/LCPQ/quantum_package/tree/master/src/Utils>`_
* `Perturbation <http://github.com/LCPQ/quantum_package/tree/master/src/Perturbation>`_