Match H2 Multipole z
Commits >
Commit cbea69fbf625d621b43d7bf990e8d9b27d6c495d >
Run spack_foss-2023b_serial >
Input 30-local_multipoles.02-multipoles.inp
Value | Reference | Precision | Status |
3.942026147098417e-01 | 3.942026147098392e-01 | 3.940000000000000e-15 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 6)