Match Hartree energy
Commits >
Commit 12c5144371d4b1b6f2306d5bbdf3ce56936365b0 >
Run foss-2022a_opt >
Input 18-TiO2.01-gs.inp
Value | Reference | Precision | Status |
4.244572708000000e+01 | 4.244572722000000e+01 | 2.880000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)