Materials Data on ScNiP by Materials Project
ScNiP is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Sc2+ is bonded in a 6-coordinate geometry to six equivalent P3- atoms. All Sc–P bond lengths are 2.84 Å. Ni1+ is bonded to four equivalent P3- atoms to form corner-sharing NiP4 tetrahedra. All Ni–P bond lengths are 2.46 Å. P3- is bonded in a 10-coordinate geometry to six equivalent Sc2+ and four equivalent Ni1+ 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:
- 1313402
- Report Number(s):
- mp-961675
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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