Match PBE0 Fock Total
Commits >
Commit 94d58911903c32860449c62a795f2d74d19217f9 >
Run foss_mpi_opt_autotools: [foss2023a-mpi] >
Input 03-xc.pbe0_fock.inp
Value | Reference | Precision | Status |
-5.804006100000000e-01 | -5.803856600000000e-01 | 1.640000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)