Match H2 Multipole y
Commits >
Commit 82f7aa8a8814f63eea2470b6e96d2be6e7b330f6 >
Run spack_foss-2022a_serial_opt >
Input 30-local_multipoles.02-multipoles.inp
| Value | Reference | Precision | Status |
| -3.942030529108305e-01 | -3.942030529108270e-01 | 1.970000000000000e-14 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 5)