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mirror of https://github.com/LCPQ/quantum_package synced 2025-03-20 07:36:49 +01:00
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qmcpack
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Normalize the AO basis using GAMESS convention and save it inside the EZFIO.
Then the python script is called.

Needed Modules
==============
.. Do not edit this section It was auto-generated
.. by the `update_README.py` script.
Documentation
=============
.. Do not edit this section It was auto-generated
.. by the `update_README.py` script.