Match Occupation 1s up
Commits >
Commit dd0acda4415b0ab64c529ca4a26922f9782edb94 >
Run spack_foss-2022a_cuda_serial >
Input 04-ACBN0_isolated.01-H_unpacked.inp
Value | Reference | Precision | Status |
9.872353500000000e-01 | 9.872353500000000e-01 | 4.940000000000000e-07 | PASS |
Command: LINEFIELD(static/occ_matrices, -3, 1)