Match Benzene Multipoles [step 20]
Commits >
Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 >
Run foss-mpi-debug: [foss2023a-mpi] >
Input 12-tddft-currents-to-maxwell.03-benzene-mxll-td-veloc-gauge.inp
Value | Reference | Precision | Status |
-2.094497201627422e-02 | -2.094497201627904e-02 | 1.670000000000000e-14 | PASS |
Command: LINEFIELD(benzene/td.general/multipoles, -1, 4)