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This repository is version 1 of QP. This version is not supported any more. Version 2 is available here : https://github.com/QuantumPackage/qp2
304 Commits 6 Branches 5 Tags 93 MiB
Fortran 80.5%
OCaml 9.4%
Python 5.5%
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Anthony Scemama fb2b7966e1 Determinants check the nb of alpha and beta electrons
2014-11-04 00:10:17 +01:00
bin Improved setup scripts to auto-install curl and m4 2014-10-23 22:40:21 +02:00
data Added VDZ basis set 2014-10-27 22:19:48 +01:00
doc Added documentation and Makefile 2014-04-01 18:21:01 +02:00
ocaml Determinants check the nb of alpha and beta electrons 2014-11-04 00:10:17 +01:00
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README.rst Make all_modules and all_clean compiles in parallel. Added NEEDED_MODULES 2014-04-03 11:19:41 +02:00
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README.rst 

===============
Quantum package
===============

Set of quantum chemistry programs and libraries.

For more information, you can visit the
`wiki of the project <http://github.com/LCPQ/quantum_package/wiki>`_