Materials Data on Zr4ZnAg by Materials Project

Zr4AgZn crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are three inequivalent Zr sites. In the first Zr site, Zr is bonded in a 6-coordinate geometry to three equivalent Ag and three equivalent Zn atoms. All Zr–Ag bond lengths are 2.83 Å. All Zr–Zn bond lengths are 2.75 Å. In the second Zr site, Zr is bonded in a 2-coordinate geometry to two equivalent Ag and two equivalent Zn atoms. Both Zr–Ag bond lengths are 3.28 Å. Both Zr–Zn bond lengths are 2.83 Å. In the third Zr site, Zr is bonded in a 2-coordinate geometry to two equivalent Ag and two equivalent Zn atoms. Both Zr–Ag bond lengths are 2.99 Å. Both Zr–Zn bond lengths are 3.23 Å. Ag is bonded in a 12-coordinate geometry to nine Zr and three equivalent Ag atoms. All Ag–Ag bond lengths are 3.00 Å. Zn is bonded in a 9-coordinate geometry to nine Zr atoms.