Match Energy [step 5]
Commits >
Commit 1f10c93c74388b17aea6526c581521be8cd6aa14 >
Run spack_foss-2022a_cuda_serial >
Input 05-time_propagation.06-td_fast_md.inp
Value | Reference | Precision | Status |
-3.790974154516930e+01 | -3.790974154516920e+01 | 2.000000000000000e-13 | PASS |
Command: LINEFIELD(td.general/energy, -16, 3)