Match Occupation Ni2 down 3d5
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_mpi_autotools: [foss2023a-mpi] >
Input 01-nio.01-U5-gs.inp
Value | Reference | Precision | Status |
9.462556800000000e-01 | 9.462559800000000e-01 | 5.440000000000000e-07 | PASS |
Command: LINEFIELD(static/occ_matrices, -1, 9)