Match Energy [step 20]
Commits >
Commit 0eb882d93dcc47f8554e98f5f256d6c6053dae9c >
Run spack_foss-2022a_cuda_serial >
Input 14-fullerene_unpacked.03-td-packed.inp
Value | Reference | Precision | Status |
-3.184088237669064e+02 | -3.184088237668212e+02 | 1.590000000000000e-10 | PASS |
Command: LINEFIELD(td.general/energy, -1, 3)