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lammps/bench-accel/bench_fene/in.fene
22d64270f1e1lammm-master-deprecated

in.fene
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			# FENE beadspring benchmark

			units lj
			atom_style bond
			special_bonds fene

			read_data data.fene

			neighbor 0.4 bin
			neigh_modify delay 5 every 1

			bond_style fene
			bond_coeff 1 30.0 1.5 1.0 1.0

			pair_style lj/cut 1.12
			pair_modify shift yes
			pair_coeff 1 1 1.0 1.0 1.12

			fix 1 all nve
			fix 2 all langevin 1.0 1.0 10.0 904297

			timestep 0.012
			thermo 10

			run 100