Materials Data on Zr2InCo2 by Materials Project

Dataset · Thu Jul 16 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1197379· OSTI ID:1197379

The Materials Project

Zr2Co2In crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Zr is bonded in a 6-coordinate geometry to six equivalent Co and four equivalent In atoms. There are two shorter (2.67 Å) and four longer (2.71 Å) Zr–Co bond lengths. All Zr–In bond lengths are 3.15 Å. Co is bonded in a 6-coordinate geometry to six equivalent Zr, one Co, and two equivalent In atoms. The Co–Co bond length is 2.58 Å. Both Co–In bond lengths are 2.85 Å. In is bonded to eight equivalent Zr, four equivalent Co, and two equivalent In atoms to form a mixture of distorted corner and face-sharing InZr8In2Co4 cuboctahedra. Both In–In bond lengths are 3.30 Å.

• 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: 1197379
• Report Number(s): mp-22150
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
Zr2InCo2
Co-In-Zr