Materials Data on PtPbF6 by Materials Project
PtPbF6 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Pt4+ is bonded to six equivalent F1- atoms to form PtF6 octahedra that share corners with six equivalent PbF12 cuboctahedra and faces with two equivalent PbF12 cuboctahedra. All Pt–F bond lengths are 1.97 Å. Pb2+ is bonded to twelve equivalent F1- atoms to form PbF12 cuboctahedra that share corners with six equivalent PtF6 octahedra, edges with six equivalent PbF12 cuboctahedra, and faces with two equivalent PtF6 octahedra. The corner-sharing octahedral tilt angles are 41°. All Pb–F bond lengths are 2.78 Å. F1- is bonded in a distorted single-bond geometry to one Pt4+ and two equivalent Pb2+ atoms.
- Research Organization:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Contributing Organization:
- MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- OSTI ID:
- 1195589
- Report Number(s):
- mp-20458
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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