Match Benzene Energy [step 20]
Commits >
Commit 1a80ca3478da7edc19284ff737aa0abfc175abac >
Run intel-2022a >
Input 12-tddft-currents-to-maxwell.06-benzene-dipole-and-quadrupole.inp
Value | Reference | Precision | Status |
-3.744343275070417e+01 | -3.744343182885780e+01 | 3.000000000000000e-03 | PASS |
Command: LINEFIELD(benzene/td.general/energy, -1, 3)