Match B3LYP OEP Total
Commits >
Commit c9606f298ccf4e57d14167459d26815f7508aa3e >
Run foss_mpi_autotools: [foss2022a-mpi] >
Input 03-xc.b3lyp_oep.inp
Value | Reference | Precision | Status |
-5.258437100000000e-01 | -5.258245950000000e-01 | 2.100000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)