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Title: Materials Data on LiVTeO5 by Materials Project

Abstract

LiVTeO5 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Li1+ is bonded to six O2- atoms to form distorted edge-sharing LiO6 octahedra. There are a spread of Li–O bond distances ranging from 2.10–2.53 Å. V5+ is bonded in a 4-coordinate geometry to five O2- atoms. There are a spread of V–O bond distances ranging from 1.65–2.46 Å. Te4+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Te–O bond distances ranging from 1.89–2.77 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one V5+ and one Te4+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Li1+ and one V5+ atom. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to one Li1+, one V5+, and one Te4+ atom. In the fourth O2- site, O2- is bonded to two equivalent Li1+, one V5+, and one Te4+ atom to form distorted corner-sharing OLi2VTe trigonal pyramids.

Publication Date:
Other Number(s):
mp-775216
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; LiVTeO5; Li-O-Te-V
OSTI Identifier:
1302867
DOI:
https://doi.org/10.17188/1302867

Citation Formats

The Materials Project. Materials Data on LiVTeO5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1302867.
The Materials Project. Materials Data on LiVTeO5 by Materials Project. United States. doi:https://doi.org/10.17188/1302867
The Materials Project. 2020. "Materials Data on LiVTeO5 by Materials Project". United States. doi:https://doi.org/10.17188/1302867. https://www.osti.gov/servlets/purl/1302867. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1302867,
title = {Materials Data on LiVTeO5 by Materials Project},
author = {The Materials Project},
abstractNote = {LiVTeO5 crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Li1+ is bonded to six O2- atoms to form distorted edge-sharing LiO6 octahedra. There are a spread of Li–O bond distances ranging from 2.10–2.53 Å. V5+ is bonded in a 4-coordinate geometry to five O2- atoms. There are a spread of V–O bond distances ranging from 1.65–2.46 Å. Te4+ is bonded in a 4-coordinate geometry to four O2- atoms. There are a spread of Te–O bond distances ranging from 1.89–2.77 Å. There are four inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one V5+ and one Te4+ atom. In the second O2- site, O2- is bonded in a distorted single-bond geometry to two equivalent Li1+ and one V5+ atom. In the third O2- site, O2- is bonded in a distorted trigonal planar geometry to one Li1+, one V5+, and one Te4+ atom. In the fourth O2- site, O2- is bonded to two equivalent Li1+, one V5+, and one Te4+ atom to form distorted corner-sharing OLi2VTe trigonal pyramids.},
doi = {10.17188/1302867},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}