TREXIO + MCSCF wavefunction#92

Merged

sunqm merged 17 commits into

pyscf:masterfrom

NastaMauger:master

Aug 17, 2025

Commits on Jan 30, 2025

MCSCF object can now be directly registered using TREXIO capabilities
NastaMauger
committed

Commits on Feb 17, 2025

Update occsa and occsb to also register core orbitals
NastaMauger
committed

Commits on Jul 5, 2025

Correct read_eri
NastaMauger
committed

Commits on Jul 20, 2025