eginer
|
1769efddca
|
fixed the qp_test of tc_scf
|
2024-03-12 16:52:53 +01:00 |
|
eginer
|
2ea789bee9
|
removed STUPID stop in save_tc_natorb
|
2024-03-08 17:25:48 +01:00 |
|
Emmanuel Giner
|
df2d43d51c
|
Merge pull request #321 from AbdAmmar/dev-stable
Dev stable
|
2024-03-05 17:45:06 +01:00 |
|
eginer
|
36bae4971d
|
added some j for plotting
|
2024-02-29 18:44:40 +01:00 |
|
AbdAmmar
|
8e2d2120b0
|
Merge pull request #33 from QuantumPackage/dev-stable
Dev stable
|
2024-02-27 19:02:41 +01:00 |
|
eginer
|
b9932c0e77
|
added swaping between Left/Right MOs when large angles
|
2024-02-26 15:33:36 +01:00 |
|
AbdAmmar
|
7fc4c81485
|
few modif
|
2024-02-23 23:51:03 +01:00 |
|
AbdAmmar
|
6fa207a9fb
|
Boys & Handy Jastrow: OK
|
2024-02-16 16:45:54 +01:00 |
|
AbdAmmar
|
b4ba0eda6f
|
new keywords for Jastrow
|
2024-01-15 12:05:26 +01:00 |
|
AbdAmmar
|
ef60141fbf
|
new keywords for Jastrow
|
2024-01-15 12:02:38 +01:00 |
|
AbdAmmar
|
bc1957c45a
|
print angles for tc-scf
|
2023-12-28 17:14:12 +01:00 |
|
|
b95c8142a5
|
Moved many modules in plugins/local for quicker installation
|
2023-11-07 10:27:34 +01:00 |
|