../../td/EquilibriumCrystalStructure__TD_457028483760_000/runner Al Nb AB2_tP30_136_ai_fij a c/a x2 x3 y3 x4 y4 x5 z5 standard 1 10.0244 0.52055983 0.39689091 0.73857057 0.066596546 0.87161424 0.53543895 0.81817126 0.7479355 LJ_ElliottAkerson_2015_Universal__MO_959249795837_003