Match Energy [step 5]
Commits >
Commit ea6affb390844fd1d159151b43e705a091215c1a >
Run spack_foss-2023a_mpi_opt >
Input 05-time_propagation.06-td_fast_md.inp
Value | Reference | Precision | Status |
-3.790974154516931e+01 | -3.790974154516920e+01 | 2.000000000000000e-13 | PASS |
Command: LINEFIELD(td.general/energy, -16, 3)