Match Occupation Ni2 up-down 3d4
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 07-noncollinear.02-acbn0.inp
Value | Reference | Precision | Status |
-3.210356000000000e-02 | -3.151064000000000e-02 | 6.710000000000000e-04 | PASS |
Command: LINEFIELD(static/occ_matrices, -2, 7)