Materials Data on Li(HoSe2)3 by Materials Project
HoLi(HoSe2)2(Se)2 crystallizes in the orthorhombic Cmmm space group. The structure is two-dimensional and consists of two holmium molecules; four selenium molecules; and one Li(HoSe2)2 sheet oriented in the (0, 0, 1) direction. In the Li(HoSe2)2 sheet, Li1+ is bonded in a distorted rectangular see-saw-like geometry to four equivalent Se+1.67- atoms. All Li–Se bond lengths are 2.57 Å. Ho3+ is bonded in a linear geometry to two equivalent Se+1.67- atoms. Both Ho–Se bond lengths are 2.65 Å. Se+1.67- is bonded in a distorted bent 150 degrees geometry to one Li1+ and one Ho3+ atom.
- 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:
- 1730883
- Report Number(s):
- mp-1206577
- Country of Publication:
- United States
- Language:
- English
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