Match H2 Multipole z
Commits >
Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a >
Run spack_foss-2023a_mpi >
Input 30-local_multipoles.03-multipoles_restart.inp
Value | Reference | Precision | Status |
3.942026147098414e-01 | 3.942026147098392e-01 | 3.940000000000000e-15 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 6)