|
|
44ef244fc0
|
Merge branch 'master' of gitlab.com:scemama/qp_plugins_scemama
|
2022-01-10 13:19:25 +01:00 |
|
|
|
a11bbf629d
|
Fix pseudos
|
2022-01-10 13:19:22 +01:00 |
|
|
|
ae30d07000
|
Fix bug with trexio hdf5
|
2022-01-10 10:42:35 +01:00 |
|
|
|
d9237ab271
|
Fix ECP part
|
2022-01-03 02:10:16 +01:00 |
|
|
|
f87df2b4e9
|
Import trexio
|
2021-12-30 14:42:50 +01:00 |
|
|
|
a3d0f2f921
|
Merge branch 'master' of gitlab.com:scemama/qp_plugins_scemama
|
2021-12-17 19:28:48 +01:00 |
|
|
|
e485e512f7
|
Update trexio plugin
|
2021-12-10 18:42:49 +01:00 |
|
|
|
dbc66c0c55
|
Storing ERI
|
2021-12-08 11:09:54 +01:00 |
|
|
|
427f0569a6
|
Update for TREXIOv2
|
2021-12-07 19:30:23 +01:00 |
|
|
|
8eef226634
|
Det-CSF conversion
|
2021-12-03 14:48:52 +01:00 |
|
|
|
be17a1cc0d
|
Fix trexio
|
2021-10-12 16:00:27 +02:00 |
|
|
|
b7fcc7f9c3
|
Fixed normalization in trexio
|
2021-08-24 15:14:29 +02:00 |
|
|
|
cf3b4fe449
|
Curved for Cyrus
|
2021-06-25 00:03:06 +02:00 |
|
|
|
08a66a51b5
|
Added abproducts
|
2021-06-08 15:40:54 +02:00 |
|
|
|
f816f9b668
|
Fix HDF5 in configure
|
2021-06-03 01:18:05 +02:00 |
|
|
|
0ea3df3502
|
Improving trexio export
|
2021-05-06 19:58:30 +02:00 |
|
|
|
1df54bc2fe
|
Added electron group
|
2021-05-06 10:40:36 +02:00 |
|
|
|
e6b198990a
|
Coord
|
2021-05-05 18:17:56 +02:00 |
|
|
|
5fcb287955
|
Start writing trexio file
|
2021-05-05 17:15:14 +02:00 |
|
