Match H2-4 Multipole y
Commits >
Commit 15b914f6cf8a906b04634cf1151edac44a3f54fa >
Run spack_foss-2022a_cuda_serial >
Input 30-local_multipoles.02-multipoles.inp
Value | Reference | Precision | Status |
-3.863555142688248e-01 | -3.863555142688210e-01 | 1.930000000000000e-14 | PASS |
Command: LINEFIELD(local.general/multipoles/H2-4.multipoles, -1, 5)