Match Occupation Ni2 down 3d5
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 02-ACBN0.01-nio.inp
Value | Reference | Precision | Status |
9.951782400000000e-01 | 9.951790500000000e-01 | 9.240000000000000e-07 | PASS |
Command: LINEFIELD(static/occ_matrices, -1, 9)