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Commit Graph

6 Commits

Author SHA1 Message Date
1e12eba42b Changed how libraries are handled 2023-09-19 14:43:42 +02:00
579a52b504 Added hydrogen in ccECP 2020-05-11 10:21:01 +02:00
398b7a2d32 Add ccECP data 2020-05-07 01:16:13 +02:00
7aa00c1fc3 Changed ncsu in ccecp 2020-05-07 00:40:26 +02:00
Anouar Benali
452bd1142f 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
2019-05-24 16:19:34 -05:00
24d9745056 Initial commit 2019-01-25 11:39:31 +01:00