Match H2 Multipole z
Commits >
Commit 49118372ba86b967cc9f5fccbbf24835f53b10d7 >
Run spack_intel-2023a_impi >
Input 30-local_multipoles.02-multipoles.inp
| Value | Reference | Precision | Status |
| 3.942030529108299e-01 | 3.942030529108260e-01 | 1.970000000000000e-14 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 6)