U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on CaSiPd by Materials Project
Abstract
CaPdSi crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ca2+ is bonded in a 5-coordinate geometry to five equivalent Si4- atoms. There are a spread of Ca–Si bond distances ranging from 3.03–3.18 Å. Pd2+ is bonded in a distorted trigonal planar geometry to three equivalent Si4- atoms. There are a spread of Pd–Si bond distances ranging from 2.43–2.49 Å. Si4- is bonded in a 9-coordinate geometry to five equivalent Ca2+, three equivalent Pd2+, and one Si4- atom. The Si–Si bond length is 2.69 Å.
- Publication Date:
- Other Number(s):
- mp-8842
- 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; Ca-Pd-Si; CaSiPd; crystal structure
- OSTI Identifier:
- 1312762
- DOI:
- https://doi.org/10.17188/1312762
Citation Formats
Materials Data on CaSiPd by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1312762.
Materials Data on CaSiPd by Materials Project. United States. doi:https://doi.org/10.17188/1312762
2020.
"Materials Data on CaSiPd by Materials Project". United States. doi:https://doi.org/10.17188/1312762. https://www.osti.gov/servlets/purl/1312762. Pub date:Thu Jul 16 04:00:00 UTC 2020
@article{osti_1312762,
title = {Materials Data on CaSiPd by Materials Project},
abstractNote = {CaPdSi crystallizes in the monoclinic P2_1/c space group. The structure is three-dimensional. Ca2+ is bonded in a 5-coordinate geometry to five equivalent Si4- atoms. There are a spread of Ca–Si bond distances ranging from 3.03–3.18 Å. Pd2+ is bonded in a distorted trigonal planar geometry to three equivalent Si4- atoms. There are a spread of Pd–Si bond distances ranging from 2.43–2.49 Å. Si4- is bonded in a 9-coordinate geometry to five equivalent Ca2+, three equivalent Pd2+, and one Si4- atom. The Si–Si bond length is 2.69 Å.},
doi = {10.17188/1312762},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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