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Pull requests: pyscf/pyscf-forge

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Pull requests list

TDDFT-ris with an all-in-one krylov solver
#170 opened Jan 16, 2026 by John-zzh Loading…
ppRPA: fix bug and improve efficiency
#169 opened Jan 12, 2026 by lijiachen417 Loading…
1
Implemented write_1e_int_eri and write_2e_int_eri
#168 opened Jan 10, 2026 by kousuke-nakano • Draft
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…
39
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
[Work in progress] LNOCC
#115 opened Feb 25, 2025 by hongzhouye Loading…
2 of 4 tasks
17
[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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