Match Benzene Energy [step 20]
Commits >
Commit d89ed1adec8f63937926022ba961c15ddb98b66b >
Run foss-ppc: [foss2022a-serial] >
Input 12-tddft-currents-to-maxwell.02-benzene-mxll-td-length-gauge.inp
Value | Reference | Precision | Status |
-3.744565857691558e+01 | -3.744565857691556e+01 | 3.740000000000000e-13 | PASS |
Command: LINEFIELD(benzene/td.general/energy, -1, 3)