Materials Data on SbPdSe by Materials Project
PdSbSe is Spinel-like structured and crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Pd4+ is bonded to three equivalent Sb2- and three equivalent Se2- atoms to form PdSb3Se3 octahedra that share corners with twelve equivalent PdSb3Se3 octahedra, corners with three equivalent SbPd3Se tetrahedra, and corners with three equivalent SeSbPd3 tetrahedra. The corner-sharing octahedra tilt angles range from 63–64°. All Pd–Sb bond lengths are 2.69 Å. All Pd–Se bond lengths are 2.66 Å. Sb2- is bonded to three equivalent Pd4+ and one Se2- atom to form distorted SbPd3Se tetrahedra that share corners with three equivalent PdSb3Se3 octahedra, corners with six equivalent SbPd3Se tetrahedra, and corners with nine equivalent SeSbPd3 tetrahedra. The corner-sharing octahedral tilt angles are 78°. The Sb–Se bond length is 2.69 Å. Se2- is bonded to three equivalent Pd4+ and one Sb2- atom to form SeSbPd3 tetrahedra that share corners with three equivalent PdSb3Se3 octahedra, corners with six equivalent SeSbPd3 tetrahedra, and corners with nine equivalent SbPd3Se tetrahedra. The corner-sharing octahedral tilt angles are 79°.
- 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:
- 1208104
- Report Number(s):
- mp-4368
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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