[Main] job=basin_hopping random_seed=1 temperature=1500 [Potential] potential=qsc [Basin Hopping] displacement_distribution=gaussian steps=100 write_unique=true [Optimizer] opt_method=cg max_iterations=10000 converged_force=0.001 max_move=0.2 [Structure Comparison] check_rotation=true indistinguishable_atoms=true distance_difference=0.05 energy_difference=0.01