Diffusion lammps (lammps-icms) Browse

lammps/tools/msi2lmp/test/in.h2-h2o-class2b
e7e5ba4e4688lammps-icms

in.h2-h2o-class2b
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			log log.h2-h2o-class2b
			units real
			atom_style full
			pair_style lj/class2/coul/cut 15.0
			bond_style class2
			angle_style class2

			read_data h2-h2o-class2b.data

			thermo_style multi
			minimize 0.0 0.0 100 1000

			write_data h2-h2o-class2b.data2