Materials Data on TlSbSe2 by Materials Project
TlSbSe2 crystallizes in the orthorhombic Cmmm space group. The structure is three-dimensional. Tl1+ is bonded to four equivalent Sb3+ and two equivalent Se2- atoms to form a mixture of corner and edge-sharing TlSb4Se2 octahedra. The corner-sharing octahedral tilt angles are 0°. All Tl–Sb bond lengths are 3.03 Å. Both Tl–Se bond lengths are 3.26 Å. Sb3+ is bonded in a square co-planar geometry to four equivalent Tl1+ atoms. Se2- is bonded in a distorted trigonal planar geometry to one Tl1+ and two equivalent Se2- atoms. Both Se–Se bond lengths are 2.43 Å.
- 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:
- 1195039
- Report Number(s):
- mp-19846
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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