LCPQ/quantum_package
10
0
Fork 0
mirror of https://github.com/LCPQ/quantum_package synced 2024-11-04 21:24:02 +01:00
Code Issues Releases Wiki Activity
f2fef4a6dc
quantum_package/data
History
TApplencourt 92094534e2 Fix qmc pack converter
2016-03-07 10:51:11 +01:00
..
basis Distributed PT2 2016-02-19 00:20:28 +01:00
ezfio_defaults n_det_max in in dets, and PT2_max and var_pt2_max are in Perturbation. Delete all the multiple occurance 2015-05-12 15:14:54 +02:00
pseudo Pseudo in OCaml 2016-01-25 15:44:15 +01:00
.gitignore Removed useless stuff in data (old input files) 2015-01-15 16:44:55 +01:00
list_element.txt Fix qmc pack converter 2016-03-07 10:51:11 +01:00
README.rst Merge branch 'master' of https://github.com/scemama/quantum_package into scemama-master 2016-01-26 14:43:09 +01:00

README.rst 

====
Data
====


This directory contains all the data files needed for the Quantum Package.

The `basis` directory contains some of the most popular basis sets, and the
`pseudo` directory contains pseudopotential data.