Match Occupation Ni2 up-down 3d5
Commits >
Commit a41c007d955b10e3b7368ff6ffc60ddf6399c944 >
Run foss_mpi_debug_autotools: [foss2023a-mpi] >
Input 07-noncollinear.02-acbn0.inp
| Value | Reference | Precision | Status |
| -4.716754900000000e-01 | -4.716748600000000e-01 | 4.230000000000000e-07 | FAIL |
Command: LINEFIELD(static/occ_matrices, -1, 9)