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Title: Materials Data on In2SbAs by Materials Project

Abstract

In2SbAs is Enargite-like structured and crystallizes in the trigonal R3m space group. The structure is three-dimensional. there are two inequivalent In3+ sites. In the first In3+ site, In3+ is bonded to three equivalent Sb3- and one As3- atom to form corner-sharing InSb3As tetrahedra. All In–Sb bond lengths are 2.82 Å. The In–As bond length is 2.67 Å. In the second In3+ site, In3+ is bonded to one Sb3- and three equivalent As3- atoms to form corner-sharing InSbAs3 tetrahedra. The In–Sb bond length is 2.88 Å. All In–As bond lengths are 2.74 Å. Sb3- is bonded to four In3+ atoms to form SbIn4 tetrahedra that share corners with six equivalent SbIn4 tetrahedra and corners with six equivalent AsIn4 tetrahedra. As3- is bonded to four In3+ atoms to form AsIn4 tetrahedra that share corners with six equivalent SbIn4 tetrahedra and corners with six equivalent AsIn4 tetrahedra.

Publication Date:
Other Number(s):
mp-1223844
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; In2SbAs; As-In-Sb
OSTI Identifier:
1757751
DOI:
https://doi.org/10.17188/1757751

Citation Formats

The Materials Project. Materials Data on In2SbAs by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1757751.
The Materials Project. Materials Data on In2SbAs by Materials Project. United States. doi:https://doi.org/10.17188/1757751
The Materials Project. 2020. "Materials Data on In2SbAs by Materials Project". United States. doi:https://doi.org/10.17188/1757751. https://www.osti.gov/servlets/purl/1757751. Pub date:Thu Sep 03 00:00:00 EDT 2020
@article{osti_1757751,
title = {Materials Data on In2SbAs by Materials Project},
author = {The Materials Project},
abstractNote = {In2SbAs is Enargite-like structured and crystallizes in the trigonal R3m space group. The structure is three-dimensional. there are two inequivalent In3+ sites. In the first In3+ site, In3+ is bonded to three equivalent Sb3- and one As3- atom to form corner-sharing InSb3As tetrahedra. All In–Sb bond lengths are 2.82 Å. The In–As bond length is 2.67 Å. In the second In3+ site, In3+ is bonded to one Sb3- and three equivalent As3- atoms to form corner-sharing InSbAs3 tetrahedra. The In–Sb bond length is 2.88 Å. All In–As bond lengths are 2.74 Å. Sb3- is bonded to four In3+ atoms to form SbIn4 tetrahedra that share corners with six equivalent SbIn4 tetrahedra and corners with six equivalent AsIn4 tetrahedra. As3- is bonded to four In3+ atoms to form AsIn4 tetrahedra that share corners with six equivalent SbIn4 tetrahedra and corners with six equivalent AsIn4 tetrahedra.},
doi = {10.17188/1757751},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {9}
}