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Title: Materials Data on Mg(VS2)2 by Materials Project

Abstract

Mg(VS2)2 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Mg2+ is bonded to four equivalent S2- atoms to form MgS4 tetrahedra that share corners with twelve equivalent VS6 octahedra. The corner-sharing octahedral tilt angles are 59°. All Mg–S bond lengths are 2.43 Å. V3+ is bonded to six equivalent S2- atoms to form VS6 octahedra that share corners with six equivalent MgS4 tetrahedra and edges with six equivalent VS6 octahedra. All V–S bond lengths are 2.46 Å. S2- is bonded to one Mg2+ and three equivalent V3+ atoms to form a mixture of distorted edge and corner-sharing SMgV3 trigonal pyramids.

Publication Date:
Other Number(s):
mvc-14450
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; Mg(VS2)2; Mg-S-V
OSTI Identifier:
1319142
DOI:
https://doi.org/10.17188/1319142

Citation Formats

The Materials Project. Materials Data on Mg(VS2)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1319142.
The Materials Project. Materials Data on Mg(VS2)2 by Materials Project. United States. doi:https://doi.org/10.17188/1319142
The Materials Project. 2020. "Materials Data on Mg(VS2)2 by Materials Project". United States. doi:https://doi.org/10.17188/1319142. https://www.osti.gov/servlets/purl/1319142. Pub date:Tue May 05 00:00:00 EDT 2020
@article{osti_1319142,
title = {Materials Data on Mg(VS2)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Mg(VS2)2 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Mg2+ is bonded to four equivalent S2- atoms to form MgS4 tetrahedra that share corners with twelve equivalent VS6 octahedra. The corner-sharing octahedral tilt angles are 59°. All Mg–S bond lengths are 2.43 Å. V3+ is bonded to six equivalent S2- atoms to form VS6 octahedra that share corners with six equivalent MgS4 tetrahedra and edges with six equivalent VS6 octahedra. All V–S bond lengths are 2.46 Å. S2- is bonded to one Mg2+ and three equivalent V3+ atoms to form a mixture of distorted edge and corner-sharing SMgV3 trigonal pyramids.},
doi = {10.17188/1319142},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}