in.Be-solid.spe
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			variable sname index Be-solid
			log ${sname}.spe.log

			units electron
			newton on
			boundary p p p

			atom_style electron

			read_data data.${sname}

			pair_style eff/cut 31.6125 0 0
			pair_coeff * *

			communicate single vel yes

			neigh_modify one 10000 page 100000

			compute effTemp all temp/eff

			thermo 10
			thermo_style custom step etotal pe ke temp press
			thermo_modify temp effTemp

			dump 1 all custom 1 ${sname}.spe.lammpstrj id type x y z spin eradius

			fix 1 all nve/eff

			run 0

lammps/examples/USER/eff/Be-solid/in.Be-solid.spe5a5b74f63150lammm-master