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Title: Materials Data on Al2BiS4 by Materials Project

Abstract

Al2BiS4 crystallizes in the tetragonal P4/nnc space group. The structure is three-dimensional. there are two inequivalent Al3+ sites. In the first Al3+ site, Al3+ is bonded to four equivalent S2- atoms to form edge-sharing AlS4 tetrahedra. All Al–S bond lengths are 2.28 Å. In the second Al3+ site, Al3+ is bonded to four equivalent S2- atoms to form edge-sharing AlS4 tetrahedra. All Al–S bond lengths are 2.28 Å. Bi2+ is bonded in a rectangular see-saw-like geometry to four equivalent S2- atoms. All Bi–S bond lengths are 2.87 Å. S2- is bonded in a 3-coordinate geometry to two Al3+ and one Bi2+ atom.

Publication Date:
Other Number(s):
mp-557737
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; Al2BiS4; Al-Bi-S
OSTI Identifier:
1269981
DOI:
https://doi.org/10.17188/1269981

Citation Formats

The Materials Project. Materials Data on Al2BiS4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1269981.
The Materials Project. Materials Data on Al2BiS4 by Materials Project. United States. doi:https://doi.org/10.17188/1269981
The Materials Project. 2020. "Materials Data on Al2BiS4 by Materials Project". United States. doi:https://doi.org/10.17188/1269981. https://www.osti.gov/servlets/purl/1269981. Pub date:Wed Jul 22 00:00:00 EDT 2020
@article{osti_1269981,
title = {Materials Data on Al2BiS4 by Materials Project},
author = {The Materials Project},
abstractNote = {Al2BiS4 crystallizes in the tetragonal P4/nnc space group. The structure is three-dimensional. there are two inequivalent Al3+ sites. In the first Al3+ site, Al3+ is bonded to four equivalent S2- atoms to form edge-sharing AlS4 tetrahedra. All Al–S bond lengths are 2.28 Å. In the second Al3+ site, Al3+ is bonded to four equivalent S2- atoms to form edge-sharing AlS4 tetrahedra. All Al–S bond lengths are 2.28 Å. Bi2+ is bonded in a rectangular see-saw-like geometry to four equivalent S2- atoms. All Bi–S bond lengths are 2.87 Å. S2- is bonded in a 3-coordinate geometry to two Al3+ and one Bi2+ atom.},
doi = {10.17188/1269981},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}