Match H2 Multipole y
Commits >
Commit abc749737cc12a5b79d975879ed425be2e62065f >
Run eb_foss-2022b_libxc6 >
Input 30-local_multipoles.03-multipoles_restart.inp
Value | Reference | Precision | Status |
-3.942030529108314e-01 | -3.942030529108270e-01 | 1.970000000000000e-14 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 5)