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Title: Materials Data on AgBiSCl2 by Materials Project

Abstract

AgBiSCl2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Ag1+ is bonded to two equivalent S2- and four equivalent Cl1- atoms to form a mixture of distorted edge and corner-sharing AgS2Cl4 octahedra. The corner-sharing octahedral tilt angles are 57°. Both Ag–S bond lengths are 2.47 Å. All Ag–Cl bond lengths are 3.09 Å. Bi3+ is bonded in a 8-coordinate geometry to two equivalent S2- and six equivalent Cl1- atoms. Both Bi–S bond lengths are 2.71 Å. There are two shorter (2.81 Å) and four longer (3.21 Å) Bi–Cl bond lengths. S2- is bonded to two equivalent Ag1+ and two equivalent Bi3+ atoms to form distorted corner-sharing SAg2Bi2 tetrahedra. Cl1- is bonded in a 5-coordinate geometry to two equivalent Ag1+ and three equivalent Bi3+ atoms.

Publication Date:
Other Number(s):
mp-556094
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; AgBiSCl2; Ag-Bi-Cl-S
OSTI Identifier:
1269166
DOI:
10.17188/1269166

Citation Formats

The Materials Project. Materials Data on AgBiSCl2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1269166.
The Materials Project. Materials Data on AgBiSCl2 by Materials Project. United States. doi:10.17188/1269166.
The Materials Project. 2020. "Materials Data on AgBiSCl2 by Materials Project". United States. doi:10.17188/1269166. https://www.osti.gov/servlets/purl/1269166. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1269166,
title = {Materials Data on AgBiSCl2 by Materials Project},
author = {The Materials Project},
abstractNote = {AgBiSCl2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Ag1+ is bonded to two equivalent S2- and four equivalent Cl1- atoms to form a mixture of distorted edge and corner-sharing AgS2Cl4 octahedra. The corner-sharing octahedral tilt angles are 57°. Both Ag–S bond lengths are 2.47 Å. All Ag–Cl bond lengths are 3.09 Å. Bi3+ is bonded in a 8-coordinate geometry to two equivalent S2- and six equivalent Cl1- atoms. Both Bi–S bond lengths are 2.71 Å. There are two shorter (2.81 Å) and four longer (3.21 Å) Bi–Cl bond lengths. S2- is bonded to two equivalent Ag1+ and two equivalent Bi3+ atoms to form distorted corner-sharing SAg2Bi2 tetrahedra. Cl1- is bonded in a 5-coordinate geometry to two equivalent Ag1+ and three equivalent Bi3+ atoms.},
doi = {10.17188/1269166},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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