U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ni3Sn2 by Materials Project
Abstract
Ni3Sn2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 5-coordinate geometry to six equivalent Ni and five Sn atoms. There are four shorter (2.65 Å) and two longer (2.72 Å) Ni–Ni bond lengths. There are a spread of Ni–Sn bond distances ranging from 2.50–2.61 Å. In the second Ni site, Ni is bonded in a 11-coordinate geometry to five Ni and six Sn atoms. There are one shorter (2.56 Å) and one longer (2.66 Å) Ni–Ni bond lengths. There are a spread of Ni–Sn bond distances ranging from 2.61–2.91 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 10-coordinate geometry to eight Ni and two equivalent Sn atoms. Both Sn–Sn bond lengths are 3.18 Å. In the second Sn site, Sn is bonded in a 9-coordinate geometry to nine Ni atoms.
- Publication Date:
- Other Number(s):
- mp-669720
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; Ni-Sn; Ni3Sn2; crystal structure
- OSTI Identifier:
- 1281726
- DOI:
- https://doi.org/10.17188/1281726
Citation Formats
Materials Data on Ni3Sn2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1281726.
Materials Data on Ni3Sn2 by Materials Project. United States. doi:https://doi.org/10.17188/1281726
2020.
"Materials Data on Ni3Sn2 by Materials Project". United States. doi:https://doi.org/10.17188/1281726. https://www.osti.gov/servlets/purl/1281726. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1281726,
title = {Materials Data on Ni3Sn2 by Materials Project},
abstractNote = {Ni3Sn2 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. there are two inequivalent Ni sites. In the first Ni site, Ni is bonded in a 5-coordinate geometry to six equivalent Ni and five Sn atoms. There are four shorter (2.65 Å) and two longer (2.72 Å) Ni–Ni bond lengths. There are a spread of Ni–Sn bond distances ranging from 2.50–2.61 Å. In the second Ni site, Ni is bonded in a 11-coordinate geometry to five Ni and six Sn atoms. There are one shorter (2.56 Å) and one longer (2.66 Å) Ni–Ni bond lengths. There are a spread of Ni–Sn bond distances ranging from 2.61–2.91 Å. There are two inequivalent Sn sites. In the first Sn site, Sn is bonded in a 10-coordinate geometry to eight Ni and two equivalent Sn atoms. Both Sn–Sn bond lengths are 3.18 Å. In the second Sn site, Sn is bonded in a 9-coordinate geometry to nine Ni atoms.},
doi = {10.17188/1281726},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}