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Doc and cosmetic fixes for RHODYN 2 of 3 checklist items completed!462
- Merged
- 5
- Approved
updated -
Minor updates to EPRA and PRPRop keys 3 of 3 checklist items completed!604
- Merged
- 3
- Approved
updated -
Non-Orthogonal Configuration Interaction - Interface to GronOR, Documentation, and Test 3 of 3 checklist items completed!603
- Merged
- Approved
updated -
HFC unit converter 3 of 3 checklist items completed!597
- Merged
- Approved
updated -
Make it possible to define different spaces for the action of HEXS and DEXS keywords 3 of 3 checklist items completed!596
- Merged
- 5
- Approved
updated -
- Merged
- 39
- Approved
updated -
Added LEVEL_2022 3 of 3 checklist items completed!580
- Merged
- 119
- Approved
updated -
Use data from runfile to obtain proper orbital labels in FCIDUMP 3 of 3 checklist items completed!595
- Merged
- 4
- Approved
updated -
Restructure determinant treatment before gtdmctl loop in RASSI 3 of 3 checklist items completed!594
- Merged
- 4
- Approved
updated -
Frenkelexcitons 3 of 3 checklist items completed!593
- Merged
- 13
- Approved
updated -
- Merged
- Approved
updated -
Sigma-p regularization in CASPT2 3 of 3 checklist items completed!590
- Merged
- 3
- Approved
updated -
Removal of getmems in integral_util 3 of 3 checklist items completed!586
- Merged
- 1
- Approved
updated -
fine tuning the rs-RFO option in the SCF code. 3 of 3 checklist items completed!582
- Merged
- Approved
updated -
Fix for 2-step MCLR run 3 of 3 checklist items completed!584
- Merged
- Approved
updated -
PCM noneq model for ionized state 2 of 2 checklist items completed!563
- Merged
- 19
- Approved
updated -
Surfacehop phase 3 of 3 checklist items completed!579
- Merged
- Approved
updated -
Code modernization (runfile_util, cct3_util, misc_util) 3 of 3 checklist items completed!583
- Merged
- Approved
updated -
New scf driver 3 of 3 checklist items completed!529
- Merged
- Approved
updated