Materials Data on ZrNi4Sn by Materials Project

Dataset · Sun May 03 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1205169· OSTI ID:1205169

The Materials Project

ZrNi4Sn crystallizes in the cubic F-43m space group. The structure is three-dimensional. Zr is bonded in a 12-coordinate geometry to twelve equivalent Ni and four equivalent Sn atoms. All Zr–Ni bond lengths are 2.87 Å. All Zr–Sn bond lengths are 3.00 Å. Ni is bonded to three equivalent Zr, six equivalent Ni, and three equivalent Sn atoms to form a mixture of edge, corner, and face-sharing NiZr3Ni6Sn3 cuboctahedra. There are three shorter (2.44 Å) and three longer (2.46 Å) Ni–Ni bond lengths. All Ni–Sn bond lengths are 2.87 Å. Sn is bonded in a 4-coordinate geometry to four equivalent Zr and twelve equivalent Ni atoms.

• Research Organization: Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
• Sponsoring Organization: USDOE Office of Science (SC), Basic Energy Sciences (BES)
• Contributing Organization: MIT; UC Berkeley; Duke; U Louvain
• DOE Contract Number: AC02-05CH11231; EDCBEE
• OSTI ID: 1205169
• Report Number(s): mp-30807
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
ZrNi4Sn
Ni-Sn-Zr