Match H2 Multipole x
Commits >
Commit f72050fe95608e153e1887ef05d1ad42dc082fde >
Run valgrind: [foss2023a-serial] >
Input 30-local_multipoles.03-multipoles_restart.inp
Value | Reference | Precision | Status |
-3.942026147098421e-01 | -3.942026147098388e-01 | 4.000000000000000e-15 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 4)