Match B3LYP OEP Total
Commits >
Commit 9275f20b3bb016ad64b9c976787ebb2f42f235b1 >
Run spack_foss-2023b_serial >
Input 03-xc.b3lyp_oep.inp
| Value | Reference | Precision | Status |
| -5.258437000000000e-01 | -5.258245950000000e-01 | 2.100000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Total =', 3)