in.colloid
fd0e404679calammm-master-deprecated

in.colloid
View Options

			# Big colloid particles and small LJ particles

			units lj
			atom_style atomic
			dimension 2

			lattice sq 0.01
			region box block 0 30 0 30 -0.5 0.5
			create_box 2 box
			create_atoms 1 box

			set group all type/fraction 2 0.96 23984

			mass 1 9
			mass 2 1

			velocity all create 1.44 87287 loop geom

			# multi neighbor and comm for efficiency

			neighbor 1 multi
			neigh_modify delay 0
			communicate multi

			# colloid potential

			pair_style colloid 12.5
			pair_coeff 1 1 1.0 1.0 5.0 5.0 12.5
			pair_coeff 1 2 5.0 1.0 5.0 0.0 7.0
			pair_coeff 2 2 10.0 1.0 0.0 0.0 2.5

			fix 1 all npt 2.0 2.0 1.0 xyz 0.0 1.0 10.0 drag 1.0
			fix 2 all enforce2d

			dump 1 all atom 200 dump.colloid

			thermo_style custom step temp epair etotal press vol
			thermo 1000

			timestep 0.005

			run 50000