Match Energy [step 20]
Commits >
Commit a207e10cd726e9ee7bae9ea565d18a80e5fdcb20 >
Run foss-mpi-opt-full: [foss2023a-mpi] >
Input 14-fullerene_unpacked.03-td-packed.inp
Value | Reference | Precision | Status |
-3.184094654954790e+02 | -3.184094654954693e+02 | 5.150000000000000e-11 | PASS |
Command: LINEFIELD(td.general/energy, -1, 3)