Match Occupation Ni2 down 3d4
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run intel-serial: [intel2023a-serial] >
Input 02-ACBN0.01-nio.inp
Value | Reference | Precision | Status |
9.732666200000000e-01 | 9.732680000000000e-01 | 1.240000000000000e-06 | FAIL |
Command: LINEFIELD(static/occ_matrices, -2, 7)