Match Energy [step 20]
Commits >
Commit 2cbd57b62c972cb2ebea8f328fb20b62d521e0ac >
Run spack_foss-2022a_mpi >
Input 14-fullerene_unpacked.03-td-packed.inp
Value | Reference | Precision | Status |
-3.184088237669058e+02 | -3.184088237668212e+02 | 1.590000000000000e-10 | PASS |
Command: LINEFIELD(td.general/energy, -1, 3)