in.compute_bond-001
6eb1ade2f0adlammps-icms

in.compute_bond-001
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			atom_style bond
			timer off
			read_data compute_bond.data

			pair_style lj/cut 5.0
			bond_style harmonic

			pair_coeff * * 1.0 1.0
			bond_coeff * 1.0 1.0

			compute 1 all bond harmonic

			thermo_style custom step etotal epair ebond c_1

			run 0 post no