Match PBE0 Fock Eigenvalue up
Commits >
Commit db5a37a45dcf968be97880dd1f5766f32ce63f3a >
Run cuda-serial: [foss2022a-cuda-mpi] >
Input 03-xc.pbe0_fock.inp
Value | Reference | Precision | Status |
-1.024691000000000e+00 | -1.024722000000000e+00 | 3.410000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 up', 3)