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Further improvements for DFT numerical quadrature 3 of 3 checklist items completed!499
- Merged
- 10
- Approved
updated -
Fix external Libxc and check version 3 of 3 checklist items completed!500
- Merged
- Approved
updated -
Full implemention of LibXC in OpenMOLCAS 3 of 3 checklist items completed!492
- Merged
- 23
- Approved
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Update to Libxc 5.2.0 3 of 3 checklist items completed!497
- Merged
- 9
- Approved
updated -
Cleanup after implementation of LibXC 3 of 3 checklist items completed!495
- Merged
- 2
- Approved
updated -
Put isotope data in an external file 3 of 3 checklist items completed!494
- Merged
- 1
- Approved
updated -
Changes for NAG compiler 3 of 3 checklist items completed!491
- Merged
- Approved
updated -
Fix for #324 3 of 3 checklist items completed!490
- Merged
- 1
- Approved
updated -
Code modernization (fock_util, mula, guga) 3 of 3 checklist items completed!485
- Merged
- Approved
updated -
Aniso bug fix 3 of 3 checklist items completed!488
- Merged
- Approved
updated -
Rho stucture IV 3 of 3 checklist items completed!483
- Merged
- 3
- Approved
updated -
Faster pdft2 3 of 3 checklist items completed!486
- Merged
- Approved
updated -
Fix wiki link in README 2 of 3 checklist items completed!484
- Merged
- 3
- Approved
updated -
Allow LINALG=Manual and pass explicit libraries to external projects 3 of 3 checklist items completed!430
- Merged
- 3
- Approved
updated -
Rho stucture III 3 of 3 checklist items completed!481
- Merged
- Approved
updated -
Unified matrix exponential 3 of 3 checklist items completed!482
- Merged
- Approved
updated -
Rho Structure II 3 of 3 checklist items completed!478
- Merged
- 1
- Approved
updated -
Fast pdft gradient 3 of 3 checklist items completed!480
- Merged
- 4
- Approved
updated -
CI: new Intel image 3 of 3 checklist items completed!479
- Merged
- Approved
updated