Match Unnormalized charge
Commits >
Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a >
Run spack_foss-2022a_mpi_min >
Input 17-hgh_occupations.01-W.inp
Value | Reference | Precision | Status |
6.159403000000000e+00 | 6.158967000000000e+00 | 4.820000000000000e-04 | PASS |
Command: GREPFIELD(out, 'Unnormalized total charge = ', 6)