Match Energy [step 20]
Commits >
Commit efc44ae2259e56922145db535c825ce53e4127cb >
Run foss_mpi_autotools: [foss2022a-mpi] >
Input 14-fullerene_unpacked.02-td-unpacked.inp
Value | Reference | Precision | Status |
-3.184094654954758e+02 | -3.184094654954693e+02 | 5.150000000000000e-11 | PASS |
Command: LINEFIELD(td.general/energy, -1, 3)