Match Multipoles [step 20]
Commits >
Commit d48128afc066bfe2b1bb5979f9ee62249e46c834 >
Run spack_foss-2023a_serial_omp >
Input 14-fullerene_unpacked.03-td-packed.inp
Value | Reference | Precision | Status |
-2.020313227808285e+00 | -2.020315146839614e+00 | 5.140000000000000e-06 | PASS |
Command: LINEFIELD(td.general/multipoles, -1, 4)