|
|
643e68a43b
|
C2
|
2019-05-20 09:42:12 +02:00 |
|
|
|
72ddc17b86
|
CBS values
|
2019-05-16 14:43:16 +02:00 |
|
|
|
99ec8dfa83
|
update CH2
|
2019-05-13 15:48:45 +02:00 |
|
Emmanuel Giner
|
3d3cc92cce
|
added the remaining singlets in AVTZ for ethylene
|
2018-12-14 00:26:14 +01:00 |
|
Emmanuel Giner
|
4fbfb82d84
|
Merge branch 'master' of https://github.com/pfloos/srDFT
|
2018-12-14 00:17:23 +01:00 |
|
Emmanuel Giner
|
a4c6e402c9
|
added ethyelene and classified the data
|
2018-12-14 00:17:10 +01:00 |
|
eginer
|
9253a16030
|
added the data_ethylene
|
2018-12-11 16:24:24 +01:00 |
|
eginer
|
2e0ccf9827
|
added data_water_sorted
|
2018-12-10 13:32:04 +01:00 |
|
Emmanuel Giner
|
633d185990
|
added data
|
2018-12-05 18:14:12 +01:00 |
|
Pierre-Francois Loos
|
a77310d625
|
Initial commit by T2
|
2018-11-30 23:43:13 +01:00 |
|
