Match Hartree energy
Commits >
Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a >
Run spack_intel-2023a_impi >
Input 12-boron_nitride.02-gs_gamma.inp
Value | Reference | Precision | Status |
-5.223230991100000e+02 | -5.223230991099999e+02 | 2.610000000000000e-07 | PASS |
Command: GREPFIELD(static/info, 'Hartree =', 3)