ZrFe2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. Zr(1) is bonded in a 16-coordinate geometry to four equivalent Zr(1) and twelve equivalent Fe(1) atoms. Fe(1) is bonded to six equivalent Zr(1) and six equivalent Fe(1) atoms to form a mixture of corner, face, and edge-sharing FeZr6Fe6 cuboctahedra.
ZrFe2 is Cubic Laves structured and crystallizes in the cubic Fd-3m space group. Zr(1) is bonded in a 16-coordinate geometry to four equivalent Zr(1) and twelve equivalent Fe(1) atoms. All Zr(1)-Zr(1) bond lengths are 3.07 Å. All Zr(1)-Fe(1) bond lengths are 2.94 Å. Fe(1) is bonded to six equivalent Zr(1) and six equivalent Fe(1) atoms to form a mixture of corner, face, and edge-sharing FeZr6Fe6 cuboctahedra. All Fe(1)-Fe(1) bond lengths are 2.51 Å.