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Title: Materials Data on HAuO2 by Materials Project

Abstract

AuOOH crystallizes in the orthorhombic Pmn2_1 space group. The structure is two-dimensional and consists of two AuOOH sheets oriented in the (0, 0, 1) direction. Au3+ is bonded in a square co-planar geometry to four O2- atoms. There are two shorter (2.03 Å) and two longer (2.05 Å) Au–O bond lengths. H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.08 Å) and one longer (1.41 Å) H–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Au3+ and one H1+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Au3+ and one H1+ atom.

Authors:
Publication Date:
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)
Contributing Org.:
MIT; UC Berkeley; Duke; U Louvain
OSTI Identifier:
1317103
Report Number(s):
mp-996985
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Resource Type:
Data
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English
Subject:
36 MATERIALS SCIENCE; crystal structure; HAuO2; Au-H-O

Citation Formats

The Materials Project. Materials Data on HAuO2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1317103.
The Materials Project. Materials Data on HAuO2 by Materials Project. United States. https://doi.org/10.17188/1317103
The Materials Project. 2020. "Materials Data on HAuO2 by Materials Project". United States. https://doi.org/10.17188/1317103. https://www.osti.gov/servlets/purl/1317103.
@article{osti_1317103,
title = {Materials Data on HAuO2 by Materials Project},
author = {The Materials Project},
abstractNote = {AuOOH crystallizes in the orthorhombic Pmn2_1 space group. The structure is two-dimensional and consists of two AuOOH sheets oriented in the (0, 0, 1) direction. Au3+ is bonded in a square co-planar geometry to four O2- atoms. There are two shorter (2.03 Å) and two longer (2.05 Å) Au–O bond lengths. H1+ is bonded in a linear geometry to two O2- atoms. There is one shorter (1.08 Å) and one longer (1.41 Å) H–O bond length. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Au3+ and one H1+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Au3+ and one H1+ atom.},
doi = {10.17188/1317103},
url = {https://www.osti.gov/biblio/1317103}, journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu Jul 23 00:00:00 EDT 2020},
month = {Thu Jul 23 00:00:00 EDT 2020}
}