lammps/examples/latte/data.ch4

24 lines
707 B
Plaintext

LAMMPS Description
5 atoms
2 atom types
0.0000000000000000 19.523000000000000 xlo xhi
0.0000000000000000 12.757999999999999 ylo yhi
0.0000000000000000 11.692000000000000 zlo zhi
0.0000000000000000 0.0000000000000000 0.0000000000000000 xy xz yz
Masses
1 12.010000000000000
2 1.0078250169754028
Atoms
1 1 1 0.0 -9.16600 2.05200 0.00000
2 1 2 0.0 -8.09600 2.05200 0.00000
3 1 2 0.0 -9.52300 2.75800 -0.72000
4 1 2 0.0 -9.52300 2.32200 0.97200
5 1 2 0.0 -9.52300 1.07500 -0.25200