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Materials Data on Sc2CO by Materials Project

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DataCite Commons2021-02-04 更新2025-04-09 收录
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https://www.osti.gov/servlets/purl/1750531/
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资源简介:
Sc2CO is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Sc3+ is bonded to three equivalent C4- and three equivalent O2- atoms to form a mixture of corner and edge-sharing ScC3O3 octahedra. The corner-sharing octahedral tilt angles are 0°. All Sc–C bond lengths are 2.27 Å. All Sc–O bond lengths are 2.33 Å. C4- is bonded to six equivalent Sc3+ atoms to form CSc6 octahedra that share corners with six equivalent OSc6 octahedra, edges with six equivalent CSc6 octahedra, and edges with six equivalent OSc6 octahedra. The corner-sharing octahedral tilt angles are 2°. O2- is bonded to six equivalent Sc3+ atoms to form OSc6 octahedra that share corners with six equivalent CSc6 octahedra, edges with six equivalent CSc6 octahedra, and edges with six equivalent OSc6 octahedra. The corner-sharing octahedral tilt angles are 2°.
提供机构:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
创建时间:
2020-12-30
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