Materials Data on YbBRh3 by Materials Project
YbRh3B is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Yb is bonded to twelve equivalent Rh atoms to form YbRh12 cuboctahedra that share corners with twelve equivalent YbRh12 cuboctahedra, faces with six equivalent YbRh12 cuboctahedra, and faces with eight equivalent BRh6 octahedra. All Yb–Rh bond lengths are 2.95 Å. Rh is bonded to four equivalent Yb and two equivalent B atoms to form a mixture of distorted edge, face, and corner-sharing RhYb4B2 octahedra. The corner-sharing octahedra tilt angles range from 0–60°. Both Rh–B bond lengths are 2.09 Å. B is bonded to six equivalent Rh atoms to form BRh6 octahedra that share corners with six equivalent BRh6 octahedra and faces with eight equivalent YbRh12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
- Research Organization:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1207254
- Report Number(s):
- mp-3686
- Country of Publication:
- United States
- Language:
- English
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