in.airebo
e30420fc464flammm-master-deprecated

in.airebo
View Options

			# AIREBO polyethelene benchmark

			units metal
			atom_style atomic

			read_data data.airebo

			replicate 17 16 2

			neighbor 0.5 bin
			neigh_modify delay 5 every 1

			pair_style airebo 3.0 1 1
			pair_coeff * * CH.airebo C H

			velocity all create 300.0 761341

			fix 1 all nve
			timestep 0.0005

			thermo 10
			run 100