Match Hartree energy
Commits >
Commit e20977157e4d251b72bb22e6c23e92a645445263 >
Run cmake_foss_2022a_full_mpi >
Input 03-sodium_chain.01-ground_state.inp
| Value | Reference | Precision | Status |
| -4.551474020000000e+00 | -4.551474020000000e+00 | 2.280000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)