Materials Data on ErAsSe by Materials Project
ErAsSe crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Er3+ is bonded in a 9-coordinate geometry to four equivalent As1- and five equivalent Se2- atoms. There are a spread of Er–As bond distances ranging from 3.06–3.15 Å. There are a spread of Er–Se bond distances ranging from 2.88–3.02 Å. As1- is bonded in a 8-coordinate geometry to four equivalent Er3+ and four equivalent As1- atoms. There are two shorter (2.58 Å) and two longer (2.95 Å) As–As bond lengths. Se2- is bonded in a 5-coordinate geometry to five equivalent Er3+ atoms.
- Research Organization:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1753443
- Report Number(s):
- mp-1213048
- Country of Publication:
- United States
- Language:
- English
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