Traceback (most recent call last): File "../../td/LatticeConstantHexagonalEnergy__TD_942334626465_005/runner", line 458, in a, c, cohesive_energy = get_lattice_constant(symbol, model, maxiter=500) File "../../td/LatticeConstantHexagonalEnergy__TD_942334626465_005/runner", line 385, in get_lattice_constant raise RuntimeError( RuntimeError: Lattice converged to a = 2.4689860360467293 Angstroms and c = 1.9986932649278786 Angstroms (c/a = 0.809520). The model cutoff computed was 1.9999999941513362 Angstroms. Since a > model_cutoff, the minimization has converged to a state where there are no longer intralayer forces, indicating the lattice is unstable. Command exited with non-zero status 1 {"realtime":38.51,"usertime":53.09,"systime":78.86,"memmax":62668,"memavg":0}