Match Hartree energy
Commits >
Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a >
Run spack_foss-2022a_mpi_min >
Input 22-berry.02-cubic_Si.inp
Value | Reference | Precision | Status |
3.596193506000000e+01 | 3.596187412000000e+01 | 4.250000000000000e-02 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)