LAMMPS Description 8 atoms 2 atom types 1 bond types 1 angle types 1 dihedral types 1 improper types # Cell: 6.292940 6.292940 6.292940 90.0000 90.0000 90.0000 0.000000 6.292940 xlo xhi 0.000000 6.292940 ylo yhi 0.000000 6.292940 zlo zhi Masses 1 35.45300 # Cl 2 39.10200 # K+ Atoms 1 1 2 1.00000000 0.000000 0.000000 0.000000 0 0 0 # K1 K+ 2 2 2 1.00000000 0.000000 3.146470 3.146470 0 0 0 # K2 K+ 3 3 2 1.00000000 3.146470 0.000000 3.146470 0 0 0 # K3 K+ 4 4 2 1.00000000 3.146470 3.146470 0.000000 0 0 0 # K4 K+ 5 5 1 -1.00000000 3.146470 3.146470 3.146470 0 0 0 # Cl1 Cl 6 6 1 -1.00000000 3.146470 0.000000 0.000000 0 0 0 # Cl2 Cl 7 7 1 -1.00000000 0.000000 3.146470 0.000000 0 0 0 # Cl3 Cl 8 8 1 -1.00000000 0.000000 0.000000 3.146470 0 0 0 # Cl4 Cl