U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Mg3ZnC by Materials Project
Abstract
Mg3ZnC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Mg is bonded in a linear geometry to four equivalent Zn and two equivalent C atoms. All Mg–Zn bond lengths are 3.12 Å. Both Mg–C bond lengths are 2.20 Å. Zn is bonded to twelve equivalent Mg atoms to form ZnMg12 cuboctahedra that share corners with twelve equivalent ZnMg12 cuboctahedra, faces with six equivalent ZnMg12 cuboctahedra, and faces with eight equivalent CMg6 octahedra. C is bonded to six equivalent Mg atoms to form CMg6 octahedra that share corners with six equivalent CMg6 octahedra and faces with eight equivalent ZnMg12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
- Publication Date:
- Other Number(s):
- mp-10185
- 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-Mg-Zn; Mg3ZnC; crystal structure
- OSTI Identifier:
- 1186712
- DOI:
- https://doi.org/10.17188/1186712
Citation Formats
Materials Data on Mg3ZnC by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1186712.
Materials Data on Mg3ZnC by Materials Project. United States. doi:https://doi.org/10.17188/1186712
2020.
"Materials Data on Mg3ZnC by Materials Project". United States. doi:https://doi.org/10.17188/1186712. https://www.osti.gov/servlets/purl/1186712. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1186712,
title = {Materials Data on Mg3ZnC by Materials Project},
abstractNote = {Mg3ZnC is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Mg is bonded in a linear geometry to four equivalent Zn and two equivalent C atoms. All Mg–Zn bond lengths are 3.12 Å. Both Mg–C bond lengths are 2.20 Å. Zn is bonded to twelve equivalent Mg atoms to form ZnMg12 cuboctahedra that share corners with twelve equivalent ZnMg12 cuboctahedra, faces with six equivalent ZnMg12 cuboctahedra, and faces with eight equivalent CMg6 octahedra. C is bonded to six equivalent Mg atoms to form CMg6 octahedra that share corners with six equivalent CMg6 octahedra and faces with eight equivalent ZnMg12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1186712},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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