Match PBE0 Fock Eigenvalue dn
Commits >
Commit 1bf2bc61d0085049d6bd7294e2825d85d95584e0 >
Run intel_mpi_omp_autotools: [intel2022a-mpi] >
Input 03-xc.pbe0_fock.inp
| Value | Reference | Precision | Status |
| -8.208990000000000e-01 | -8.208640000000000e-01 | 3.850000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 dn', 3)