9
1
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-12-28 22:25:39 +01:00
Commit Graph

2 Commits

Author SHA1 Message Date
Anouar Benali
f133cb1e9f NCSU ECP and Basis set (#41)
* Adding Basis Sets and ECP from NCSU. When available He core ECP are chosen instead of large core. This applies to Na Mg Al Si P S Cl and Ar

*  ECP from ncsu

* Update Readme file with description of Basis Set
2019-05-28 15:39:09 +02:00
24d9745056 Initial commit 2019-01-25 11:39:31 +01:00