Match Hartree energy
Commits >
Commit 7ddcca10159cfd3a5f031627bc95daf6cfe3e221 >
Run spack_foss-2023a_serial_opt >
Input 18-TiO2.01-gs.inp
| Value | Reference | Precision | Status |
| 4.244572557000000e+01 | 4.244572722000000e+01 | 2.880000000000000e-06 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)