Match Energy [step 20]
Commits >
Commit 224605379ecf56495eac19edf712806ff1f57d89 >
Run foss-mpi-min: [foss2023a-mpi] >
Input 14-fullerene_unpacked.03-td-packed.inp
Value | Reference | Precision | Status |
-3.184094654954888e+02 | -3.184094654954693e+02 | 5.150000000000000e-11 | PASS |
Command: LINEFIELD(td.general/energy, -1, 3)