Fix: correct Pauli-to-spinor Hamiltonian conversion for nspin=4 - #7664

Merged

mohanchen merged 18 commits into

deepmodeling:developfrom

dyzheng:fix_pauli_to_spinor

Jul 23, 2026

Commits on Jun 23, 2026

Commits on Jun 24, 2026

fix: correct DFT+U force for nspin=4 - DM is stored in Pauli basis, not spinor basis
dyzheng
committed
fix: remove force*=2.0 for nspin=4 in DeltaSpin - Pauli basis already covers all spin channels
dyzheng
committed

Commits on Jun 28, 2026

fix: correct DFT+U force/stress reference values and clean up empty nspin=4 block
dyzheng
committed

Commits on Jul 21, 2026