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Title: Materials Data on AlAgSe2 by Materials Project

Abstract

AgAlSe2 is Chalcopyrite structured and crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. Ag1+ is bonded to four equivalent Se2- atoms to form AgSe4 tetrahedra that share corners with four equivalent AgSe4 tetrahedra and corners with eight equivalent AlSe4 tetrahedra. All Ag–Se bond lengths are 2.68 Å. Al3+ is bonded to four equivalent Se2- atoms to form AlSe4 tetrahedra that share corners with four equivalent AlSe4 tetrahedra and corners with eight equivalent AgSe4 tetrahedra. All Al–Se bond lengths are 2.43 Å. Se2- is bonded to two equivalent Ag1+ and two equivalent Al3+ atoms to form corner-sharing SeAl2Ag2 tetrahedra.

Publication Date:
Other Number(s):
mp-14091
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; AlAgSe2; Ag-Al-Se
OSTI Identifier:
1189924
DOI:
10.17188/1189924

Citation Formats

The Materials Project. Materials Data on AlAgSe2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1189924.
The Materials Project. Materials Data on AlAgSe2 by Materials Project. United States. doi:10.17188/1189924.
The Materials Project. 2020. "Materials Data on AlAgSe2 by Materials Project". United States. doi:10.17188/1189924. https://www.osti.gov/servlets/purl/1189924. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1189924,
title = {Materials Data on AlAgSe2 by Materials Project},
author = {The Materials Project},
abstractNote = {AgAlSe2 is Chalcopyrite structured and crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. Ag1+ is bonded to four equivalent Se2- atoms to form AgSe4 tetrahedra that share corners with four equivalent AgSe4 tetrahedra and corners with eight equivalent AlSe4 tetrahedra. All Ag–Se bond lengths are 2.68 Å. Al3+ is bonded to four equivalent Se2- atoms to form AlSe4 tetrahedra that share corners with four equivalent AlSe4 tetrahedra and corners with eight equivalent AgSe4 tetrahedra. All Al–Se bond lengths are 2.43 Å. Se2- is bonded to two equivalent Ag1+ and two equivalent Al3+ atoms to form corner-sharing SeAl2Ag2 tetrahedra.},
doi = {10.17188/1189924},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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