Materials Data on Sc2MnSi by Materials Project
Sc2MnSi crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Sc sites. In the first Sc site, Sc is bonded to four equivalent Sc and four equivalent Si atoms to form distorted edge-sharing ScSc4Si4 tetrahedra. All Sc–Sc bond lengths are 2.76 Å. All Sc–Si bond lengths are 2.76 Å. In the second Sc site, Sc is bonded in a 4-coordinate geometry to four equivalent Sc, four equivalent Mn, and six equivalent Si atoms. All Sc–Mn bond lengths are 2.76 Å. All Sc–Si bond lengths are 3.19 Å. Mn is bonded in a distorted body-centered cubic geometry to four equivalent Sc and four equivalent Si atoms. All Mn–Si bond lengths are 2.76 Å. Si is bonded in a distorted body-centered cubic geometry to ten Sc and four equivalent Mn 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:
- 1317507
- Report Number(s):
- mp-999201
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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