Match Total current (x=-0.38, y= 0,z=0) [step 20]
Commits >
Commit ad9fcbdd35c8d08e16e213263c476bba0afb770b >
Run spack_foss-2023a_mpi_min >
Input 12-tddft-currents-to-maxwell.04-benzene-mxll-td-full-min-coup.inp
Value | Reference | Precision | Status |
9.833499753901610e-05 | 9.833499753902589e-05 | 2.000000000000000e-10 | PASS |
Command: LINEFIELD(benzene/output_iter/td.0000020/current-x.z\=0, 470, 3)