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 396, in get_lattice_constant raise RuntimeError( RuntimeError: Lattice converged to a = 2.121498154788539 Angstroms and c = 5.054067866371296 Angstroms (c/a = 2.382311), which means the distance between an atom and its nearest neighbor in an adjacent layer is 2.80822933056795 Angstroms. The model cutoff computed was 2.6499999943375876 Angstroms. Since the smallest interlayer atom distance is greater than the model_cutoff, the minimization has converged to a state where there are no longer interlayer forces, indicating the lattice is unstable. Command exited with non-zero status 1 {"realtime":7.10,"usertime":7.57,"systime":10.13,"memmax":62844,"memavg":0}