10
0
mirror of https://github.com/LCPQ/quantum_package synced 2024-09-27 12:00:56 +02:00
quantum_package/docs/source/programmers_guide/programming.rst
2018-11-23 17:00:51 +01:00

16 lines
388 B
ReStructuredText

Programming in the |qp|
=======================
To program in the |qp|, it is required that you are familiar with
the `IRPF90`_ code generator. A gitbook can be found
`here <http://scemama.gitbooks.io/irpf90>`_.
.. interface AOs / MOs => resultsFile
.. interface integrals => AO / MO
.. interface integrals MO => FCIDUMP
.. TODO : molden module in resultsFile
.. include:: /work.rst