Match Energy [step 5]
Commits >
Commit 1bf2bc61d0085049d6bd7294e2825d85d95584e0 >
Run foss-ppc: [foss2022a-serial] >
Input 05-time_propagation.06-td_fast_md.inp
Value | Reference | Precision | Status |
-3.790974154516923e+01 | -3.790974154516920e+01 | 2.000000000000000e-13 | PASS |
Command: LINEFIELD(td.general/energy, -16, 3)