Materials Data on YZnGe by 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:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1189425
- Report Number(s):
- mp-13160
- Country of Publication:
- United States
- Language:
- English
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