../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Cu Pd A3B_tP28_99_4a3b7c_3a4b a c/a z1 z2 z3 z4 z5 z6 z7 z8 z9 z10 z11 z12 z13 z14 z15 z16 z17 z18 z19 z20 z21 standard 1 3.7346 6.8826113 0.42762471 0.28539025 0.14275575 0.99865992 0.85425445 0.71049542 0.56838314 0.71015382 0.56852204 0.8539473 0.99814282 0.14221591 0.28571418 0.4277781 0.78210762 0.6392198 0.49796739 0.35670564 0.21411737 0.070511556 0.92625171 Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000