Match Hartree energy
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_autotools: [foss2022a-serial] >
Input 18-TiO2.02-gs_kerker.inp
Value | Reference | Precision | Status |
4.172762507000000e+01 | 4.172762507000000e+01 | 2.090000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)