skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on Ga2PbO4 by Materials Project

Abstract

PbGa2O4 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are four inequivalent Ga3+ sites. In the first Ga3+ site, Ga3+ is bonded to four O2- atoms to form corner-sharing GaO4 tetrahedra. There are a spread of Ga–O bond distances ranging from 1.85–1.89 Å. In the second Ga3+ site, Ga3+ is bonded to four O2- atoms to form corner-sharing GaO4 tetrahedra. There are a spread of Ga–O bond distances ranging from 1.85–1.88 Å. In the third Ga3+ site, Ga3+ is bonded to four O2- atoms to form corner-sharing GaO4 tetrahedra. There are a spread of Ga–O bond distances ranging from 1.85–1.88 Å. In the fourth Ga3+ site, Ga3+ is bonded to four O2- atoms to form corner-sharing GaO4 tetrahedra. There are a spread of Ga–O bond distances ranging from 1.85–1.88 Å. There are two inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Pb–O bond distances ranging from 2.31–2.84 Å. In the second Pb2+ site, Pb2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Pb–O bond distances ranging from 2.32–2.79 Å. There are eight inequivalentmore » O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to two Ga3+ and two Pb2+ atoms. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two Ga3+ and one Pb2+ atom. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to two Ga3+ and one Pb2+ atom. In the fourth O2- site, O2- is bonded in a 2-coordinate geometry to two Ga3+ and two Pb2+ atoms. In the fifth O2- site, O2- is bonded in a distorted trigonal planar geometry to two Ga3+ and one Pb2+ atom. In the sixth O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two Ga3+ and one Pb2+ atom. In the seventh O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two Ga3+ and one Pb2+ atom. In the eighth O2- site, O2- is bonded in a distorted trigonal planar geometry to two Ga3+ and one Pb2+ atom.« less

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:
1271772
Report Number(s):
mp-561013
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; Ga2PbO4; Ga-O-Pb

Citation Formats

The Materials Project. Materials Data on Ga2PbO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1271772.
The Materials Project. Materials Data on Ga2PbO4 by Materials Project. United States. https://doi.org/10.17188/1271772
The Materials Project. 2020. "Materials Data on Ga2PbO4 by Materials Project". United States. https://doi.org/10.17188/1271772. https://www.osti.gov/servlets/purl/1271772.
@article{osti_1271772,
title = {Materials Data on Ga2PbO4 by Materials Project},
author = {The Materials Project},
abstractNote = {PbGa2O4 crystallizes in the triclinic P1 space group. The structure is three-dimensional. there are four inequivalent Ga3+ sites. In the first Ga3+ site, Ga3+ is bonded to four O2- atoms to form corner-sharing GaO4 tetrahedra. There are a spread of Ga–O bond distances ranging from 1.85–1.89 Å. In the second Ga3+ site, Ga3+ is bonded to four O2- atoms to form corner-sharing GaO4 tetrahedra. There are a spread of Ga–O bond distances ranging from 1.85–1.88 Å. In the third Ga3+ site, Ga3+ is bonded to four O2- atoms to form corner-sharing GaO4 tetrahedra. There are a spread of Ga–O bond distances ranging from 1.85–1.88 Å. In the fourth Ga3+ site, Ga3+ is bonded to four O2- atoms to form corner-sharing GaO4 tetrahedra. There are a spread of Ga–O bond distances ranging from 1.85–1.88 Å. There are two inequivalent Pb2+ sites. In the first Pb2+ site, Pb2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Pb–O bond distances ranging from 2.31–2.84 Å. In the second Pb2+ site, Pb2+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Pb–O bond distances ranging from 2.32–2.79 Å. There are eight inequivalent O2- sites. In the first O2- site, O2- is bonded in a 2-coordinate geometry to two Ga3+ and two Pb2+ atoms. In the second O2- site, O2- is bonded in a distorted trigonal planar geometry to two Ga3+ and one Pb2+ atom. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to two Ga3+ and one Pb2+ atom. In the fourth O2- site, O2- is bonded in a 2-coordinate geometry to two Ga3+ and two Pb2+ atoms. In the fifth O2- site, O2- is bonded in a distorted trigonal planar geometry to two Ga3+ and one Pb2+ atom. In the sixth O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two Ga3+ and one Pb2+ atom. In the seventh O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to two Ga3+ and one Pb2+ atom. In the eighth O2- site, O2- is bonded in a distorted trigonal planar geometry to two Ga3+ and one Pb2+ atom.},
doi = {10.17188/1271772},
url = {https://www.osti.gov/biblio/1271772}, journal = {},
number = ,
volume = ,
place = {United States},
year = {Mon Jul 20 00:00:00 EDT 2020},
month = {Mon Jul 20 00:00:00 EDT 2020}
}