Match H2 Multipole y
Commits >
Commit af26893c7aa01c4d6db9b9440ccd945f9c92b2ee >
Run spack_foss-2023b_serial >
Input 30-local_multipoles.02-multipoles.inp
| Value | Reference | Precision | Status |
| -3.942030529108324e-01 | -3.942030529108270e-01 | 1.970000000000000e-14 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 5)