Match H2 Multipole y
Commits >
Commit 08a123e8337f28f39929f3cca3eabd71ca2e24e9 >
Run intel-parallel: [intel2023a-mpi] >
Input 30-local_multipoles.03-multipoles_restart.inp
Value | Reference | Precision | Status |
-3.942026147098415e-01 | -3.942026147098386e-01 | 3.940000000000000e-15 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 5)