simulation_name al_reax tabulate_long_range 1000 traj_title al energy_update_freq 0 bond_graph_cutoff 0.3 !bond order cutoff for bondgraphs nbrhood_cutoff 4.5 thb_cutoff 0.001 ! three body cutoff hbond_cutoff 0 bond_graph_cutoff 0.3 q_err 1e-6 ! average per atom error norm allowed in GMRES convergence write_freq 0 !writing freq of traj geo_format 0 !xyz atom_info 1 atom_forces 1 atom_velocities 1 bond_info 1 angle_info 1