Match H2 Multipole x
Commits >
Commit 4ba8d1ba4a84cee910627f85cb1ba733d430c04d >
Run intel-serial: [intel2023a-serial] >
Input 30-local_multipoles.03-multipoles_restart.inp
Value | Reference | Precision | Status |
-3.942026147098404e-01 | -3.942026147098388e-01 | 4.000000000000000e-15 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 4)