in.granregion.box
44841f689127lammm-devel

in.granregion.box
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			# pouring spheres into container box

			units lj
			atom_style sphere
			boundary f f f
			dimension 3
			comm_modify vel yes

			region box block -10 10 -10 10 -10 10 units box
			create_box 2 box

			pair_style hybrid gran/hooke 4000.0 NULL 100.0 NULL 0.5 1
			pair_coeff * * gran/hooke

			region container block -6 6 -6 6 -6 6 units box
			fix container all wall/gran/region hooke/history &
			4000.0 NULL 100.0 NULL 0.5 1 region container

			neighbor 0.3 bin
			neigh_modify delay 0 every 1 check yes

			fix 2 all nve/sphere
			fix 3 all gravity 1.0 vector 0 0 -1

			region slab block -2 2 -2 2 -2 2 units box
			fix ins all pour 100 2 4767548 vol 0.4 10 &
			diam one 1.0 region slab ignore

			timestep 0.005

			compute 1 all temp
			compute_modify 1 dynamic/dof yes

			compute 2 all temp/sphere
			compute_modify 2 dynamic/dof yes

			thermo 100
			thermo_style custom step atoms temp c_1 c_2 press
			thermo_modify lost ignore
			compute_modify thermo_temp dynamic/dof yes

			#dump 2 all image 100 image.*.jpg type type &
			# zoom 1.4 adiam 1.0 box no 0.0 axes yes 0.9 0.03
			#dump_modify 2 pad 5

			run 5000

			region container delete
			variable theta equal (step-5000)(4.0PI/5000)
			region container block -6 6 -6 6 -6 6 units box &
			rotate v_theta 0 0 0 0 0 1
			run 5000

			region container delete
			region container block -6 6 -6 6 -6 6 units box
			run 5000

			region container delete
			variable theta equal (step-15000)(4.0PI/5000)
			region container block -6 6 -6 6 -6 6 units box &
			rotate v_theta 0 0 0 1 1 1
			run 5000

			region container delete
			region container block -6 6 -6 6 -6 6 units box
			run 5000