Match PBE0 Fock Eigenvalue dn
Commits >
Commit f72050fe95608e153e1887ef05d1ad42dc082fde >
Run intel_mpi_autotools: [intel2023a-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)