Match B3LYP Fock Eigenvalue up
Commits >
Commit c1843387c3c25bf42356cee40f04165a0aff5f6f >
Run intel_mpi_omp_autotools: [intel2022a-mpi] >
Input 03-xc.b3lyp_fock.inp
| Value | Reference | Precision | Status |
| -1.019204000000000e+00 | -1.019171000000000e+00 | 3.630000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 up', 3)