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Title: Materials Data on SrIn5Au3 by Materials Project

Abstract

SrAu3In5 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Sr is bonded in a 6-coordinate geometry to six Au atoms. There are a spread of Sr–Au bond distances ranging from 3.41–3.55 Å. There are three inequivalent Au sites. In the first Au site, Au is bonded in a 9-coordinate geometry to two equivalent Sr and seven In atoms. There are a spread of Au–In bond distances ranging from 2.75–3.12 Å. In the second Au site, Au is bonded in a 9-coordinate geometry to two equivalent Sr and seven In atoms. There are a spread of Au–In bond distances ranging from 2.81–3.03 Å. In the third Au site, Au is bonded in a 9-coordinate geometry to two equivalent Sr and seven In atoms. There are a spread of Au–In bond distances ranging from 2.81–3.09 Å. There are five inequivalent In sites. In the first In site, In is bonded to four Au atoms to form a mixture of distorted edge and corner-sharing InAu4 tetrahedra. In the second In site, In is bonded to four Au atoms to form a mixture of distorted edge and corner-sharing InAu4 tetrahedra. In the third In site, In is bonded in a 4-coordinatemore » geometry to four Au atoms. In the fourth In site, In is bonded in a 5-coordinate geometry to five Au atoms. In the fifth In site, In is bonded to four Au atoms to form a mixture of distorted edge and corner-sharing InAu4 tetrahedra.« less

Publication Date:
Other Number(s):
mp-1209007
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; SrIn5Au3; Au-In-Sr
OSTI Identifier:
1729550
DOI:
https://doi.org/10.17188/1729550

Citation Formats

The Materials Project. Materials Data on SrIn5Au3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1729550.
The Materials Project. Materials Data on SrIn5Au3 by Materials Project. United States. doi:https://doi.org/10.17188/1729550
The Materials Project. 2020. "Materials Data on SrIn5Au3 by Materials Project". United States. doi:https://doi.org/10.17188/1729550. https://www.osti.gov/servlets/purl/1729550. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1729550,
title = {Materials Data on SrIn5Au3 by Materials Project},
author = {The Materials Project},
abstractNote = {SrAu3In5 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Sr is bonded in a 6-coordinate geometry to six Au atoms. There are a spread of Sr–Au bond distances ranging from 3.41–3.55 Å. There are three inequivalent Au sites. In the first Au site, Au is bonded in a 9-coordinate geometry to two equivalent Sr and seven In atoms. There are a spread of Au–In bond distances ranging from 2.75–3.12 Å. In the second Au site, Au is bonded in a 9-coordinate geometry to two equivalent Sr and seven In atoms. There are a spread of Au–In bond distances ranging from 2.81–3.03 Å. In the third Au site, Au is bonded in a 9-coordinate geometry to two equivalent Sr and seven In atoms. There are a spread of Au–In bond distances ranging from 2.81–3.09 Å. There are five inequivalent In sites. In the first In site, In is bonded to four Au atoms to form a mixture of distorted edge and corner-sharing InAu4 tetrahedra. In the second In site, In is bonded to four Au atoms to form a mixture of distorted edge and corner-sharing InAu4 tetrahedra. In the third In site, In is bonded in a 4-coordinate geometry to four Au atoms. In the fourth In site, In is bonded in a 5-coordinate geometry to five Au atoms. In the fifth In site, In is bonded to four Au atoms to form a mixture of distorted edge and corner-sharing InAu4 tetrahedra.},
doi = {10.17188/1729550},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}