Materials Data on BiSBr by Materials Project
BiSBr crystallizes in the orthorhombic Pnma space group. The structure is one-dimensional and consists of two BiSBr ribbons oriented in the (1, 0, 0) direction. Bi3+ is bonded to three equivalent S2- and two equivalent Br1- atoms to form distorted edge-sharing BiS3Br2 square pyramids. There are one shorter (2.62 Å) and two longer (2.76 Å) Bi–S bond lengths. Both Bi–Br bond lengths are 3.04 Å. S2- is bonded in a 3-coordinate geometry to three equivalent Bi3+ atoms. Br1- is bonded in a distorted L-shaped geometry to two equivalent Bi3+ 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:
- 1199429
- Report Number(s):
- mp-23324
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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