# CITATION: Müller, Erhart, and Albe, J. Phys.: Condens. Mat. 19, 326220 (2007) Fe Fe Fe 1 0.0115751 0.0 1.2898716 0.3413219 0.26 1 1 1.3763540363137268 67.8647722798559 3.15 0.2 2.848104409602991 953.9485925552151