U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on BaCaSn by Materials Project
Abstract
BaCaSn crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ba is bonded in a 5-coordinate geometry to five equivalent Sn atoms. There are one shorter (3.62 Å) and four longer (3.82 Å) Ba–Sn bond lengths. Ca is bonded to four equivalent Sn atoms to form a mixture of distorted edge and corner-sharing CaSn4 tetrahedra. There are a spread of Ca–Sn bond distances ranging from 3.27–3.34 Å. Sn is bonded in a 9-coordinate geometry to five equivalent Ba and four equivalent Ca atoms.
- Publication Date:
- Other Number(s):
- mp-11265
- 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; Ba-Ca-Sn; BaCaSn; crystal structure
- OSTI Identifier:
- 1187687
- DOI:
- https://doi.org/10.17188/1187687
Citation Formats
Materials Data on BaCaSn by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1187687.
Materials Data on BaCaSn by Materials Project. United States. doi:https://doi.org/10.17188/1187687
2020.
"Materials Data on BaCaSn by Materials Project". United States. doi:https://doi.org/10.17188/1187687. https://www.osti.gov/servlets/purl/1187687. Pub date:Tue Jul 14 04:00:00 UTC 2020
@article{osti_1187687,
title = {Materials Data on BaCaSn by Materials Project},
abstractNote = {BaCaSn crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Ba is bonded in a 5-coordinate geometry to five equivalent Sn atoms. There are one shorter (3.62 Å) and four longer (3.82 Å) Ba–Sn bond lengths. Ca is bonded to four equivalent Sn atoms to form a mixture of distorted edge and corner-sharing CaSn4 tetrahedra. There are a spread of Ca–Sn bond distances ranging from 3.27–3.34 Å. Sn is bonded in a 9-coordinate geometry to five equivalent Ba and four equivalent Ca atoms.},
doi = {10.17188/1187687},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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