Match H2 Multipole y
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_debug_autotools: [foss2023a-serial] >
Input 30-local_multipoles.02-multipoles.inp
Value | Reference | Precision | Status |
-3.942026147098409e-01 | -3.942026147098386e-01 | 3.940000000000000e-15 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 5)