skip to main content
DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on RuS2 by Materials Project

Abstract

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.

Publication Date:
Other Number(s):
mp-2030
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; RuS2; Ru-S
OSTI Identifier:
1195426
DOI:
https://doi.org/10.17188/1195426

Citation Formats

The Materials Project. Materials Data on RuS2 by Materials Project. United States: N. p., 2017. Web. doi:10.17188/1195426.
The Materials Project. Materials Data on RuS2 by Materials Project. United States. doi:https://doi.org/10.17188/1195426
The Materials Project. 2017. "Materials Data on RuS2 by Materials Project". United States. doi:https://doi.org/10.17188/1195426. https://www.osti.gov/servlets/purl/1195426. Pub date:Sat May 20 00:00:00 EDT 2017
@article{osti_1195426,
title = {Materials Data on RuS2 by Materials Project},
author = {The Materials Project},
abstractNote = {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.},
doi = {10.17188/1195426},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}