Match H2 Multipole z
Commits >
Commit adb0a770f40b5954f8a07de2fe2e63c9718fe526 >
Run eb_foss-2022a_mpi_debug >
Input 30-local_multipoles.02-multipoles.inp
Value | Reference | Precision | Status |
3.942030529108310e-01 | 3.942030529108260e-01 | 1.970000000000000e-14 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 6)