Materials Data on BiSeI by Materials Project
BiSeI crystallizes in the orthorhombic Pnma space group. The structure is one-dimensional and consists of two BiSeI ribbons oriented in the (1, 0, 0) direction. Bi3+ is bonded to three equivalent Se2- and two equivalent I1- atoms to form distorted edge-sharing BiSe3I2 square pyramids. There are one shorter (2.74 Å) and two longer (2.90 Å) Bi–Se bond lengths. Both Bi–I bond lengths are 3.24 Å. Se2- is bonded in a 3-coordinate geometry to three equivalent Bi3+ atoms. I1- 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:
- 1199171
- Report Number(s):
- mp-23020
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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