Materials Data on Zr2(TiSn)3 by Materials Project
Zr2(TiSn)3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. Zr is bonded in a 6-coordinate geometry to six equivalent Sn atoms. All Zr–Sn bond lengths are 2.98 Å. Ti is bonded in a 5-coordinate geometry to five equivalent Sn atoms. There are a spread of Ti–Sn bond distances ranging from 2.78–3.04 Å. Sn is bonded in a 9-coordinate geometry to four equivalent Zr and five equivalent Ti 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:
- 1704254
- Report Number(s):
- mp-1215790
- Country of Publication:
- United States
- Language:
- English
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