|
|
6e6ef8df2d
|
MPI improved and 3-electron F12 optimized
|
2020-02-05 17:41:57 +01:00 |
|
|
|
acb2314be4
|
Adapt for Notebooks
|
2019-12-02 14:58:48 +01:00 |
|
|
|
08e41378dd
|
Rephasing
|
2019-11-14 10:58:57 +01:00 |
|
|
|
b72a1e251e
|
Added Hartree-Fock guess with projection
|
2019-03-04 19:01:54 +01:00 |
|
|
|
5540db632c
|
Fixed Farm
|
2019-03-02 16:48:35 +01:00 |
|
|
|
6e68eef645
|
A lot of cleaning in HF
|
2019-03-01 21:56:46 +01:00 |
|
|
|
4b9e2016aa
|
Some cleaning
|
2019-03-01 11:50:48 +01:00 |
|
|
|
61c380f31e
|
Added Command_line module
|
2019-02-25 14:36:59 +01:00 |
|
|
|
ecf61058f9
|
S2 is programmed in CI
|
2019-02-22 19:19:11 +01:00 |
|
|
|
1d4560418e
|
Hartree-Fock is parallel
|
2018-10-23 13:39:06 +02:00 |
|
|
|
eb54ee8ab5
|
Pretty print RHF
|
2018-05-30 18:07:05 +02:00 |
|
|
|
c23821e098
|
Added HartreeFock
|
2018-02-23 18:44:31 +01:00 |
|
