Match Hartree energy
Commits >
Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf >
Run spack_foss-2023a_serial_opt >
Input 12-boron_nitride.01-gs.inp
| Value | Reference | Precision | Status |
| -5.236158370300000e+02 | -5.236158373600000e+02 | 8.630000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)