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33d70af2e5
quantum_package/plugins/qmcpack
History
TApplencourt 33d70af2e5 Correct the qmcpack script
2016-02-04 18:50:40 +01:00
..
NEEDED_CHILDREN_MODULES Added qmcpack module 2016-01-19 17:06:57 +01:00
qp_convert_qmcpack_from_ezfio.py Correct the qmcpack script 2016-02-04 18:50:40 +01:00
README.rst Added qmcpack module 2016-01-19 17:06:57 +01:00
save_for_qmcpack.irp.f Corrected 2016-01-19 17:35:32 +01:00

README.rst 

=======
qmcpack
=======

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.