Match B3LYP Fock Eigenvalue up
Commits >
Commit c7ac96946c926bee5c46ca4221093c1f60753f5a >
Run spack_foss-2022a_cuda_mpi_omp >
Input 03-xc.b3lyp_fock.inp
| Value | Reference | Precision | Status |
| -1.019138000000000e+00 | -1.019171000000000e+00 | 3.630000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 up', 3)