U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LuRh3C by Materials Project
Abstract
LuRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Lu is bonded to twelve equivalent Rh atoms to form LuRh12 cuboctahedra that share corners with twelve equivalent LuRh12 cuboctahedra, faces with six equivalent LuRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Lu–Rh bond lengths are 2.94 Å. Rh is bonded to four equivalent Lu and two equivalent C atoms to form a mixture of distorted face, edge, and corner-sharing RhLu4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.08 Å. C is bonded to six equivalent Rh atoms to form CRh6 octahedra that share corners with six equivalent CRh6 octahedra and faces with eight equivalent LuRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
- Publication Date:
- Other Number(s):
- mp-10699
- 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-Lu-Rh; LuRh3C; crystal structure
- OSTI Identifier:
- 1187300
- DOI:
- https://doi.org/10.17188/1187300
Citation Formats
Materials Data on LuRh3C by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1187300.
Materials Data on LuRh3C by Materials Project. United States. doi:https://doi.org/10.17188/1187300
2020.
"Materials Data on LuRh3C by Materials Project". United States. doi:https://doi.org/10.17188/1187300. https://www.osti.gov/servlets/purl/1187300. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1187300,
title = {Materials Data on LuRh3C by Materials Project},
abstractNote = {LuRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Lu is bonded to twelve equivalent Rh atoms to form LuRh12 cuboctahedra that share corners with twelve equivalent LuRh12 cuboctahedra, faces with six equivalent LuRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Lu–Rh bond lengths are 2.94 Å. Rh is bonded to four equivalent Lu and two equivalent C atoms to form a mixture of distorted face, edge, and corner-sharing RhLu4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.08 Å. C is bonded to six equivalent Rh atoms to form CRh6 octahedra that share corners with six equivalent CRh6 octahedra and faces with eight equivalent LuRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1187300},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}