../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner 
Si
A_hP4_194_f
a c/a z1
standard
1
3.8496 1.6527431 0.56294015
Sim_LAMMPS_Buckingham_FreitasSantosColaco_2015_SiCaOAl__SM_154093256665_000