Match Benzene Energy [step 20]
Commits >
Commit 0043f87fd1086e2efddabd576c31b5184d964264 >
Run spack_foss-2022a_mpi >
Input 12-tddft-currents-to-maxwell.02-benzene-mxll-td-length-gauge.inp
Value | Reference | Precision | Status |
-3.744565212577479e+01 | -3.744565212577614e+01 | 5.100000000000000e-08 | PASS |
Command: LINEFIELD(benzene/td.general/energy, -1, 3)