Materials Data on YZnGe by Materials Project

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

DOI:https://doi.org/10.17188/1189425· OSTI ID:1189425

The Materials Project

YZnGe crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. there are two inequivalent Y sites. In the first Y site, Y is bonded in a 12-coordinate geometry to six equivalent Zn and six equivalent Ge atoms. All Y–Zn bond lengths are 2.94 Å. All Y–Ge bond lengths are 3.26 Å. In the second Y site, Y is bonded to six equivalent Ge atoms to form distorted edge-sharing YGe6 octahedra. All Y–Ge bond lengths are 3.04 Å. Zn is bonded in a 3-coordinate geometry to three equivalent Y and three equivalent Ge atoms. All Zn–Ge bond lengths are 2.51 Å. Ge is bonded in a 6-coordinate geometry to six Y and three equivalent Zn 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: 1189425
• Report Number(s): mp-13160
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
YZnGe
Ge-Y-Zn