Match H2 Multipole x
Commits >
Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a >
Run spack_intel-2023a_impi >
Input 30-local_multipoles.03-multipoles_restart.inp
Value | Reference | Precision | Status |
-3.942030529108299e-01 | -3.942030529108270e-01 | 1.970000000000000e-14 | PASS |
Command: LINEFIELD(local.general/multipoles/H2.multipoles, -1, 4)