Match H2 Multipole x
Commits >
Commit 22a7b3628f7ddff53691f80b422d9224cf7a2498 >
Run spack_foss-2023a_mpi_debug >
Input 30-local_multipoles.02-multipoles.inp
Value | Reference | Precision | Status |
-3.942030529108306e-01 | -3.942030529108270e-01 | 1.970000000000000e-14 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 4)