Match H2 Multipole x
Commits >
Commit c18e6529b073b7f96582e125ea28d09e3ac5067c >
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)