Match Occupation Ni2 down 3d4
Commits >
Commit 81aaf54c0a876807db604366b921af6af05ee8c1 >
Run foss_mpi_autotools: [foss2022a-mpi] >
Input 01-nio.01-U5-gs.inp
Value | Reference | Precision | Status |
9.308777800000000e-01 | 9.308777000000000e-01 | 4.650000000000000e-06 | PASS |
Command: LINEFIELD(static/occ_matrices, -2, 7)