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Title: Materials Data on Lu2V2O7 by Materials Project

Abstract

Lu2V2O7 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Lu3+ is bonded in a 6-coordinate geometry to six equivalent O2- atoms. All Lu–O bond lengths are 2.19 Å. V4+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are six shorter (2.15 Å) and two longer (2.17 Å) V–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to two equivalent Lu3+ and two equivalent V4+ atoms to form a mixture of corner and edge-sharing OLu2V2 tetrahedra. In the second O2- site, O2- is bonded to four equivalent V4+ atoms to form a mixture of corner and edge-sharing OV4 tetrahedra.

Publication Date:
Other Number(s):
mp-642783
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; Lu2V2O7; Lu-O-V
OSTI Identifier:
1280162
DOI:
https://doi.org/10.17188/1280162

Citation Formats

The Materials Project. Materials Data on Lu2V2O7 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1280162.
The Materials Project. Materials Data on Lu2V2O7 by Materials Project. United States. doi:https://doi.org/10.17188/1280162
The Materials Project. 2020. "Materials Data on Lu2V2O7 by Materials Project". United States. doi:https://doi.org/10.17188/1280162. https://www.osti.gov/servlets/purl/1280162. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1280162,
title = {Materials Data on Lu2V2O7 by Materials Project},
author = {The Materials Project},
abstractNote = {Lu2V2O7 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Lu3+ is bonded in a 6-coordinate geometry to six equivalent O2- atoms. All Lu–O bond lengths are 2.19 Å. V4+ is bonded in a body-centered cubic geometry to eight O2- atoms. There are six shorter (2.15 Å) and two longer (2.17 Å) V–O bond lengths. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded to two equivalent Lu3+ and two equivalent V4+ atoms to form a mixture of corner and edge-sharing OLu2V2 tetrahedra. In the second O2- site, O2- is bonded to four equivalent V4+ atoms to form a mixture of corner and edge-sharing OV4 tetrahedra.},
doi = {10.17188/1280162},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}