Match Energy [step 20]
Commits >
Commit c461bdde143a1ab201b7896fffa943f7e4c29d0f >
Run foss-mpi-min: [foss2023a-mpi] >
Input 14-fullerene_unpacked.02-td-unpacked.inp
Value | Reference | Precision | Status |
-3.184094654954888e+02 | -3.184094654954693e+02 | 5.150000000000000e-11 | PASS |
Command: LINEFIELD(td.general/energy, -1, 3)