U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Pr2Re2Si2C by Materials Project
Abstract
Pr2Re2Si2C crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Pr3+ is bonded in a 2-coordinate geometry to five equivalent Si4- and two equivalent C4- atoms. There are a spread of Pr–Si bond distances ranging from 3.14–3.21 Å. Both Pr–C bond lengths are 2.74 Å. Re3+ is bonded in a single-bond geometry to three equivalent Si4- and one C4- atom. All Re–Si bond lengths are 2.47 Å. The Re–C bond length is 1.96 Å. Si4- is bonded in a 9-coordinate geometry to five equivalent Pr3+, three equivalent Re3+, and one Si4- atom. The Si–Si bond length is 2.83 Å. C4- is bonded to four equivalent Pr3+ and two equivalent Re3+ atoms to form edge-sharing CPr4Re2 octahedra.
- Publication Date:
- Other Number(s):
- mp-1025384
- 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; C-Pr-Re-Si; Pr2Re2Si2C; crystal structure
- OSTI Identifier:
- 1355637
- DOI:
- https://doi.org/10.17188/1355637
Citation Formats
Materials Data on Pr2Re2Si2C by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1355637.
Materials Data on Pr2Re2Si2C by Materials Project. United States. doi:https://doi.org/10.17188/1355637
2020.
"Materials Data on Pr2Re2Si2C by Materials Project". United States. doi:https://doi.org/10.17188/1355637. https://www.osti.gov/servlets/purl/1355637. Pub date:Thu Jul 23 04:00:00 UTC 2020
@article{osti_1355637,
title = {Materials Data on Pr2Re2Si2C by Materials Project},
abstractNote = {Pr2Re2Si2C crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. Pr3+ is bonded in a 2-coordinate geometry to five equivalent Si4- and two equivalent C4- atoms. There are a spread of Pr–Si bond distances ranging from 3.14–3.21 Å. Both Pr–C bond lengths are 2.74 Å. Re3+ is bonded in a single-bond geometry to three equivalent Si4- and one C4- atom. All Re–Si bond lengths are 2.47 Å. The Re–C bond length is 1.96 Å. Si4- is bonded in a 9-coordinate geometry to five equivalent Pr3+, three equivalent Re3+, and one Si4- atom. The Si–Si bond length is 2.83 Å. C4- is bonded to four equivalent Pr3+ and two equivalent Re3+ atoms to form edge-sharing CPr4Re2 octahedra.},
doi = {10.17188/1355637},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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