Match H2 Multipole y
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Run eb_fosscuda-2022a >
Input 30-local_multipoles.03-multipoles_restart.inp
Value | Reference | Precision | Status |
-3.942030529108310e-01 | -3.942030529108270e-01 | 1.970000000000000e-14 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 5)