|
casscf
|
added the diagonal hessian
|
2021-07-01 18:16:23 +02:00 |
|
cassdtq
|
Added class.irp.f
|
2019-10-01 13:02:52 +02:00 |
|
cc
|
Added svdwf module
|
2020-09-30 20:44:53 +02:00 |
|
fci_complete
|
Complete FCI
|
2021-06-07 15:15:01 +02:00 |
|
general_mrci
|
Added general MRCI
|
2020-12-15 19:02:38 +01:00 |
|
import_integrals
|
Bug fix in import_integrals_mo
|
2021-03-17 14:54:31 +01:00 |
|
mpn
|
Start writing trexio file
|
2021-05-05 17:15:14 +02:00 |
|
qmcchem
|
Estimate cost
|
2021-06-27 23:45:30 +02:00 |
|
svdwf
|
Added abproducts
|
2021-06-08 15:40:54 +02:00 |
|
trexio
|
Forgot file
|
2021-06-27 15:53:27 +02:00 |
|
.gitignore
|
champ module
|
2019-01-23 17:42:42 +01:00 |
