Match H2 Multipole x
Commits >
Commit 3186a8a51be7ad5a27ccff6e8e2901df0a16a559 >
Run spack_foss-2023a_serial_min >
Input 30-local_multipoles.03-multipoles_restart.inp
Value | Reference | Precision | Status |
-3.942026147098419e-01 | -3.942026147098388e-01 | 4.000000000000000e-15 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 4)