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Pull requests: pyscf/pyscf-forge

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Pull requests list

The DSRG-MRPT2 implementation
#102 opened Jan 13, 2025 by shuhangli98 Loading…
1
Staggered mesh method for PBC exact exchange
#98 opened Jan 3, 2025 by stephen-quiton Loading…
6
TREXIO + MCSCF wavefunction
#92 opened Dec 20, 2024 by NastaMauger Loading…
3
[WIP] Add TDDFT-ris
#86 opened Nov 25, 2024 by sunqm • Draft
Local ISDF module (with k-sampling) for PBC mean-field calculation.
#62 opened Aug 13, 2024 by NingZhang1 Loading…
11
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