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Tool for transferring (projecting) orbitals between arbitrary basis sets 3 of 3 checklist items completed!684
- Merged
- Approved
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Avoid temporary arrays 3 of 3 checklist items completed!682
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- Approved
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Fix new NAG warnings 3 of 3 checklist items completed!680
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CCSD: Fix bug 3 of 3 checklist items completed!679
- Merged
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Fix some issues with DFT grids and derivatives 3 of 3 checklist items completed!678
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Small fixes for RASSI and mort 3 of 3 checklist items completed!677
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Rassi remodel 3 of 3 checklist items completed!676
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Unify mkguga 3 of 3 checklist items completed!674
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Rasscf lucia cleanup. 3 of 3 checklist items completed!673
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Some minor updates 3 of 3 checklist items completed!672
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- Approved
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Lucia cleanup 3 of 3 checklist items completed!671
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- 1
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Draft: ONEINT to HDF5 converter. 0 of 3 checklist items completed!670
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Support for Intel LLVM compilers 3 of 3 checklist items completed!669
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External Forces enhancements 3 of 3 checklist items completed!668
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Avoid calling qpg_iScalar in PGet0 3 of 3 checklist items completed!667
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- 4
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RASSI: Fix bug with combining MS and SS files 3 of 3 checklist items completed!666
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HDF5 for LOCALISATION and EXPBAS 3 of 3 checklist items completed!665
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- Approved
updated