Match Hartree energy
Commits >
Commit 995bec41f97239ed4859b75e5397558b96cd16ab >
Run spack_foss-2023b_serial >
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)