Match Occupation Ni2 up-down 3d4
Commits >
Commit babc485c55a2119a415aa56305cb49f398154cb7 >
Run spack_foss-2022a_cuda_serial >
Input 08-loewdin.01-Si.inp
Value | Reference | Precision | Status |
1.191826500000000e+00 | 1.191826500000000e+00 | 5.960000000000000e-07 | PASS |
Command: LINEFIELD(static/occ_matrices, -2, 3)