Materials Data on CaAgP by Materials Project
CaAgP is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ca2+ is bonded in a body-centered cubic geometry to four equivalent Ag1+ and four equivalent P3- atoms. All Ca–Ag bond lengths are 2.89 Å. All Ca–P bond lengths are 2.89 Å. Ag1+ is bonded to four equivalent Ca2+ atoms to form AgCa4 tetrahedra that share corners with four equivalent PCa4 tetrahedra, corners with twelve equivalent AgCa4 tetrahedra, and edges with six equivalent PCa4 tetrahedra. P3- is bonded to four equivalent Ca2+ atoms to form PCa4 tetrahedra that share corners with four equivalent AgCa4 tetrahedra, corners with twelve equivalent PCa4 tetrahedra, and edges with six equivalent AgCa4 tetrahedra.
- 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:
- 1313373
- Report Number(s):
- mp-961647
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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