Match Energy [step 1]
Commits >
Commit 4104ea28a473696fae3c7fad4406bf86d5f6976c >
Run foss-mpi-min: [foss2022a-mpi] >
Input 02-qd_2e_2d.02-td.inp
Value | Reference | Precision | Status |
3.915739296787654e+00 | 3.915739296788000e+00 | 1.000000000000000e-04 | PASS |
Command: LINEFIELD(td.general/energy, -101, 3)