DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on BiAuO2 by Materials Project

Abstract

AuBiO2 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Au1+ is bonded in a linear geometry to two O2- atoms. Both Au–O bond lengths are 2.05 Å. Bi3+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Bi–O bond distances ranging from 2.24–2.69 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to one Au1+ and three equivalent Bi3+ atoms to form a mixture of distorted edge and corner-sharing OBi3Au tetrahedra. In the second O2- site, O2- is bonded to one Au1+ and three equivalent Bi3+ atoms to form a mixture of distorted edge and corner-sharing OBi3Au tetrahedra.

Publication Date:
Other Number(s):
mp-997082
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; BiAuO2; Au-Bi-O
OSTI Identifier:
1317170
DOI:
https://doi.org/10.17188/1317170

Citation Formats

The Materials Project. Materials Data on BiAuO2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1317170.
The Materials Project. Materials Data on BiAuO2 by Materials Project. United States. doi:https://doi.org/10.17188/1317170
The Materials Project. 2020. "Materials Data on BiAuO2 by Materials Project". United States. doi:https://doi.org/10.17188/1317170. https://www.osti.gov/servlets/purl/1317170. Pub date:Thu Jul 23 00:00:00 EDT 2020
@article{osti_1317170,
title = {Materials Data on BiAuO2 by Materials Project},
author = {The Materials Project},
abstractNote = {AuBiO2 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Au1+ is bonded in a linear geometry to two O2- atoms. Both Au–O bond lengths are 2.05 Å. Bi3+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Bi–O bond distances ranging from 2.24–2.69 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to one Au1+ and three equivalent Bi3+ atoms to form a mixture of distorted edge and corner-sharing OBi3Au tetrahedra. In the second O2- site, O2- is bonded to one Au1+ and three equivalent Bi3+ atoms to form a mixture of distorted edge and corner-sharing OBi3Au tetrahedra.},
doi = {10.17188/1317170},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}