Match Hartree energy
Commits >
Commit a4341ac9f169107ec4cef5019cc6269df7c401ac >
Run cmake_foss_2022a_min_mpi >
Input 18-TiO2.02-gs_kerker.inp
| Value | Reference | Precision | Status |
| 4.172936860000000e+01 | 4.172936816000000e+01 | 1.910000000000000e-05 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)