LCPQ/quantum_package
10
0
Fork 0
mirror of https://github.com/LCPQ/quantum_package synced 2024-12-22 20:35:19 +01:00
Code Issues Releases Wiki Activity
a3e2292b8e
quantum_package/data
History
Anthony Scemama 4ea46f2b58 Add Titanium image
2016-10-07 21:06:11 +02:00
..
basis Missing empty lines at end of basis sets 2016-09-20 09:49:20 +02:00
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 Merge branch 'master' of https://github.com/garniron/quantum_package into garniron-master 2016-07-07 13:30:58 +02:00
.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
qp.png QP Logo 2016-03-19 18:22:09 +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
Titanium.png Added Titanium image 2016-10-07 20:58:30 +02:00

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.