Match H2 Multipole y
Commits >
Commit 9972eae3cc35bad71f44bb929051f5e204f853a2 >
Run intel-serial: [intel2023a-serial] >
Input 30-local_multipoles.02-multipoles.inp
Value | Reference | Precision | Status |
-3.942026147098414e-01 | -3.942026147098386e-01 | 3.940000000000000e-15 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 5)