Match Multipoles [step 20]
Commits >
Commit b15abc005d0b5301cd748c91bbd98ee634ebaa25 >
Run spack_foss-2022a_mpi >
Input 14-fullerene_unpacked.03-td-packed.inp
Value | Reference | Precision | Status |
-2.020313222901069e+00 | -2.020315146839614e+00 | 5.140000000000000e-06 | PASS |
Command: LINEFIELD(td.general/multipoles, -1, 4)