Match Energy [step 20]
Commits >
Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e >
Run foss_mpi_min_autotools: [foss2023a-mpi] >
Input 14-fullerene_unpacked.02-td-unpacked.inp
Value | Reference | Precision | Status |
-3.184094654954888e+02 | -3.184094654954693e+02 | 3.380000000000000e-11 | PASS |
Command: LINEFIELD(td.general/energy, -1, 3)