Match H3 Electrons
Commits >
Commit 57f8ca8d342504024fed98c8f4356f69f5870627 >
Run foss-mpi-opt-full: [foss2023a-mpi] >
Input 30-local_multipoles.02-multipoles.inp
Value | Reference | Precision | Status |
8.373546248914642e-01 | 8.373546248914600e-01 | 4.190000000000000e-14 | PASS |
Command: LINEFIELD(local.general/multipoles/H3.multipoles, -1, 3)