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Draft: ONEINT to HDF5 converter. 0 of 3 checklist items completed!670
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Added AUG-PCSEG basis set to basis_library 3 of 3 checklist items completed!693
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Draft: Resolve "WFA symmetry" 0 of 3 checklist items completed!641
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Draft: MCPDFT Module 3 of 3 checklist items completed!617
- Closed
- 0 of 1 Approvals
updated -
MC-PDFT Module Clean-up (Remove dead code) 3 of 3 checklist items completed!615
- Closed
- 0 of 1 Approvals
updated -
GronOR interface capabilities merge into master branch 0 of 3 checklist items completed!599
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Update CONTRIBUTORS.md 0 of 3 checklist items completed!601
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GronOR interface capabilities merge into master branch 0 of 3 checklist items completed!598
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Draft: Start making CASPT2 compatable with 64-bit MPI. 0 of 5 checklist items completed!550
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Draft: Enable MPS driven (X/C)MS-MC-PDFT 0 of 3 checklist items completed!474
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WIP: CMS guess 3 of 3 checklist items completed!554
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Hybrid Pair Density Functional Theory. 2 of 3 checklist items completed!387
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WIP: Created PBExxx functional with varying HF exchange 1 of 3 checklist items completed!199
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WIP: New sorting feature for EXPBAS module 0 of 3 checklist items completed!136
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Coverage 0 of 3 checklist items completed!496
- Closed
- 0 of 1 Approvals
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Full implementation of LibXC 3 of 3 checklist items completed!489
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WIP: Simplify nq_util codes. 3 of 3 checklist items completed!473