U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on GdRh3C by Materials Project
Abstract
GdRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Gd is bonded to twelve equivalent Rh atoms to form GdRh12 cuboctahedra that share corners with twelve equivalent GdRh12 cuboctahedra, faces with six equivalent GdRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Gd–Rh bond lengths are 2.98 Å. Rh is bonded to four equivalent Gd and two equivalent C atoms to form a mixture of distorted edge, face, and corner-sharing RhGd4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.10 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 GdRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
- Publication Date:
- Other Number(s):
- mp-20182
- 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-Gd-Rh; crystal structure; GdRh3C
- OSTI Identifier:
- 1195322
- DOI:
- https://doi.org/10.17188/1195322
Citation Formats
Materials Data on GdRh3C by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1195322.
Materials Data on GdRh3C by Materials Project. United States. doi:https://doi.org/10.17188/1195322
2020.
"Materials Data on GdRh3C by Materials Project". United States. doi:https://doi.org/10.17188/1195322. https://www.osti.gov/servlets/purl/1195322. Pub date:Wed Jul 15 20:00:00 EDT 2020
@article{osti_1195322,
title = {Materials Data on GdRh3C by Materials Project},
abstractNote = {GdRh3C is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Gd is bonded to twelve equivalent Rh atoms to form GdRh12 cuboctahedra that share corners with twelve equivalent GdRh12 cuboctahedra, faces with six equivalent GdRh12 cuboctahedra, and faces with eight equivalent CRh6 octahedra. All Gd–Rh bond lengths are 2.98 Å. Rh is bonded to four equivalent Gd and two equivalent C atoms to form a mixture of distorted edge, face, and corner-sharing RhGd4C2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–C bond lengths are 2.10 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 GdRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1195322},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}