Match H2 Multipole y
Commits >
Commit f22bb0bcca4b53614d336c5e83de089ff68b1baa >
Run intel_mpi_autotools: [intel2023a-mpi] >
Input 30-local_multipoles.02-multipoles.inp
Value | Reference | Precision | Status |
-3.942026147098411e-01 | -3.942026147098386e-01 | 2.000000000000000e-14 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 5)