Materials Data on Cs2IrCl6 by Materials Project
Cs2IrCl6 crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. Cs1+ is bonded to twelve equivalent Cl1- atoms to form CsCl12 cuboctahedra that share corners with twelve equivalent CsCl12 cuboctahedra, faces with six equivalent CsCl12 cuboctahedra, and faces with four equivalent IrCl6 octahedra. All Cs–Cl bond lengths are 3.73 Å. Ir4+ is bonded to six equivalent Cl1- atoms to form IrCl6 octahedra that share faces with eight equivalent CsCl12 cuboctahedra. All Ir–Cl bond lengths are 2.35 Å. Cl1- is bonded in a distorted single-bond geometry to four equivalent Cs1+ and one Ir4+ atom.
- 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:
- 1202735
- Report Number(s):
- mp-28651
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
Similar Records
Materials Data on Cs2AsAuCl6 by Materials Project
Materials Data on Cs2LiLuCl6 by Materials Project
Materials Data on Cs2YCuCl6 by Materials Project
Dataset
·
Sat May 02 00:00:00 EDT 2020
·
OSTI ID:1202735
Materials Data on Cs2LiLuCl6 by Materials Project
Dataset
·
Wed Jul 15 00:00:00 EDT 2020
·
OSTI ID:1202735
Materials Data on Cs2YCuCl6 by Materials Project
Dataset
·
Tue May 05 00:00:00 EDT 2020
·
OSTI ID:1202735