Match B3LYP Fock Eigenvalue dn
Commits >
Commit fb3b67f6830f0e047754886f078a46875acffbf8 >
Run cuda-serial: [foss2022a-cuda-mpi] >
Input 03-xc.b3lyp_fock.inp
Value | Reference | Precision | Status |
-8.378890000000000e-01 | -8.379245000000000e-01 | 3.910000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 dn', 3)