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Pull requests: pyscf/pyscf-forge

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Pull requests list

Release 1.1.0
#179 opened Feb 14, 2026 by sunqm • Draft
1
add GHF-based pprpa and gradient for rpprpa
#172 opened Jan 21, 2026 by Warlocat Loading…
3
TDDFT-ris with an all-in-one krylov solver
#170 opened Jan 16, 2026 by John-zzh Loading…
Implemented writing ERIs and RDMs to a TREX-IO file.
#168 opened Jan 10, 2026 by kousuke-nakano Loading…
2
Add FOMO-CASCI and CASCI with DFT embedding extensions
#167 opened Jan 1, 2026 by arshadmehmood118 Loading…
7
Plane-Wave Mode
#161 opened Sep 10, 2025 by kylebystrom Loading…
40
RT-TDDFT
#136 opened May 5, 2025 by fishjojo Loading…
1
Add a feature tranfer template
#135 opened May 3, 2025 by sunqm Loading…
1
[WIP] clearer trexio eri interface
#105 opened Jan 20, 2025 by kgasperich • Draft
3
Local ISDF module (with k-sampling) for PBC mean-field calculation.
#62 opened Aug 13, 2024 by NingZhang1 Loading…
11
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