variable sname index Li-dendritic log ${sname}.min.log units electron newton on boundary p p p atom_style electron #read_data data.${sname} read_restart ${sname}.min.restart2 pair_style eff/cut 50.112 pair_coeff * * comm_modify vel yes compute effTemp all temp/eff thermo 10 thermo_style custom step etotal pe ke temp press thermo_modify temp effTemp compute 1 all property/atom spin eradius dump 1 all custom 10 ${sname}.min.lammpstrj id type q c_1[1] c_1[2] x y z dump 2 all xyz 10 ${sname}.min.xyz restart 10 ${sname}.nve.restart1 ${sname}.nve.restart2 #min_style cg #min_modify line quadratic dmax 2.0 #minimize 0.0 1.0e-5 10000 100000 velocity all create 300.0 4928459 rot yes dist gaussian fix 1 all nve/eff run 100