Match Occupation Ni2 up-down 3d5
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Run GCI_intel_mpi_autotools: [intel2023a-mpi] >
Input 08-loewdin.01-Si.inp
Value | Reference | Precision | Status |
1.191826330000000e+00 | 1.191826500000000e+00 | 5.960000000000000e-07 | PASS |
Command: LINEFIELD(static/occ_matrices, -1, 5)