-
Detect and avoid automatic array reallocation 3 of 3 checklist items completed!174
- Merged
- Approved
updated -
Orthonormalize rasscf 3 of 3 checklist items completed!158
- Merged
- 68
- 1
- Approved
updated -
Fix dgetrf wrapper 3 of 3 checklist items completed!173
- Merged
- 3
- Approved
updated -
New features for WFA 4 of 4 checklist items completed!172
- Merged
- 5
- Approved
updated -
Minor updates 3 of 3 checklist items completed!169
- Merged
- Approved
updated -
BUG: Change all defaults 3 of 3 checklist items completed!170
- Merged
- Approved
updated -
gridit script added 3 of 3 checklist items completed!168
- Merged
- 3
- Approved
updated -
BUGfix for 2e-CAS based NEVPT2 calculations. 3 of 3 checklist items completed!163
- Merged
- 4
- Approved
updated -
Update checkfile 819. 3 of 3 checklist items completed!165
- Merged
- 4
- Approved
updated -
Support BIGOT=ON with Intel compilers 3 of 3 checklist items completed!139
- Merged
- Approved
updated -
Allow reading SS- or MS-CASPT2 energies in RASSI 3 of 3 checklist items completed!162
- Merged
- Approved
updated -
Add BIGOT=ON to test without HDF5 3 of 3 checklist items completed!161
- Merged
- Approved
updated -
Undo wrong change 3 of 3 checklist items completed!160
- Merged
- 1
- Approved
updated -
Maintenance and bugfixes of Stochastic CASSCF 3 of 3 checklist items completed!150
- Merged
- 21
- Approved
updated -
Remove duplication 3 of 3 checklist items completed!159
- Merged
- Approved
updated -
Linearized frozen-density embedding 3 of 3 checklist items completed!157
- Merged
- 6
- Approved
updated -
Updates for NAG 6.0 compatibility 3 of 3 checklist items completed!156
- Merged
- 1
- Approved
updated -
BUGfix for correct read-in of root energies in MPSSI from .h5 file(s) 3 of 3 checklist items completed!155
- Merged
- 1
- Approved
updated -
Separation of FCIDUMP and FCIQMC 3 of 3 checklist items completed!142
- Merged
- 35
- Approved
updated