Match H2 Multipole y
Commits >
Commit ea6affb390844fd1d159151b43e705a091215c1a >
Run spack_intel-2023a_serial >
Input 30-local_multipoles.03-multipoles_restart.inp
Value | Reference | Precision | Status |
-3.942026147098405e-01 | -3.942026147098386e-01 | 3.940000000000000e-15 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 5)