Materials Data on RuS2 by Materials Project
RuS2 is Pyrite structured and crystallizes in the cubic Pa-3 space group. The structure is three-dimensional. Ru4+ is bonded to six equivalent S2- atoms to form RuS6 octahedra that share corners with twelve equivalent RuS6 octahedra and corners with six equivalent SRu3S tetrahedra. The corner-sharing octahedral tilt angles are 65°. All Ru–S bond lengths are 2.37 Å. S2- is bonded to three equivalent Ru4+ and one S2- atom to form distorted SRu3S tetrahedra that share corners with three equivalent RuS6 octahedra and corners with fifteen equivalent SRu3S tetrahedra. The corner-sharing octahedral tilt angles are 77°. The S–S bond length is 2.21 Å.
- 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:
- 1195426
- Report Number(s):
- mp-2030
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
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