Match PBE0 Fock Total
Commits >
Commit 68887e7ef149674fa38f143e8d88a44249e6d867 >
Run cuda-serial: [foss2022a-cuda-mpi] >
Input 03-xc.pbe0_fock.inp
Value | Reference | Precision | Status |
-5.803707200000000e-01 | -5.803856600000000e-01 | 1.640000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)