Match Benzene Energy [step 20]
Commits >
Commit c18e6529b073b7f96582e125ea28d09e3ac5067c >
Run spack_foss-2022a_cuda_serial >
Input 12-tddft-currents-to-maxwell.03-benzene-mxll-td-veloc-gauge.inp
Value | Reference | Precision | Status |
-3.744565216215777e+01 | -3.744565216215793e+01 | 3.740000000000000e-12 | PASS |
Command: LINEFIELD(benzene/td.general/energy, -1, 3)