Match Benzene Energy [step 0]
Commits >
Commit ea6affb390844fd1d159151b43e705a091215c1a >
Run spack_foss-2023a_serial_opt >
Input 12-tddft-currents-to-maxwell.02-benzene-mxll-td-length-gauge.inp
Value | Reference | Precision | Status |
-3.744578880864105e+01 | -3.744578880864112e+01 | 3.740000000000000e-13 | PASS |
Command: LINEFIELD(benzene/td.general/energy, -21, 3)