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Title: Materials Data on Sb2Se3 by Materials Project

Abstract

Sb2Se3 crystallizes in the orthorhombic Pnma space group. The structure is one-dimensional and consists of four Sb2Se3 ribbons oriented in the (1, 0, 0) direction. there are two inequivalent Sb3+ sites. In the first Sb3+ site, Sb3+ is bonded in a distorted T-shaped geometry to three Se2- atoms. There are one shorter (2.57 Å) and two longer (2.65 Å) Sb–Se bond lengths. In the second Sb3+ site, Sb3+ is bonded in a distorted T-shaped geometry to three Se2- atoms. There are one shorter (2.62 Å) and two longer (2.63 Å) Sb–Se bond lengths. There are three inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in an L-shaped geometry to two equivalent Sb3+ atoms. In the second Se2- site, Se2- is bonded in an L-shaped geometry to two Sb3+ atoms. In the third Se2- site, Se2- is bonded in an L-shaped geometry to two equivalent Sb3+ atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-672706
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; Sb2Se3; Sb-Se
OSTI Identifier:
1281909
DOI:
10.17188/1281909

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Sb2Se3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1281909.
Persson, Kristin, & Project, Materials. Materials Data on Sb2Se3 by Materials Project. United States. doi:10.17188/1281909.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Sb2Se3 by Materials Project". United States. doi:10.17188/1281909. https://www.osti.gov/servlets/purl/1281909. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1281909,
title = {Materials Data on Sb2Se3 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Sb2Se3 crystallizes in the orthorhombic Pnma space group. The structure is one-dimensional and consists of four Sb2Se3 ribbons oriented in the (1, 0, 0) direction. there are two inequivalent Sb3+ sites. In the first Sb3+ site, Sb3+ is bonded in a distorted T-shaped geometry to three Se2- atoms. There are one shorter (2.57 Å) and two longer (2.65 Å) Sb–Se bond lengths. In the second Sb3+ site, Sb3+ is bonded in a distorted T-shaped geometry to three Se2- atoms. There are one shorter (2.62 Å) and two longer (2.63 Å) Sb–Se bond lengths. There are three inequivalent Se2- sites. In the first Se2- site, Se2- is bonded in an L-shaped geometry to two equivalent Sb3+ atoms. In the second Se2- site, Se2- is bonded in an L-shaped geometry to two Sb3+ atoms. In the third Se2- site, Se2- is bonded in an L-shaped geometry to two equivalent Sb3+ atoms.},
doi = {10.17188/1281909},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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