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

Title: Materials Data on V2Zn2O7 by Materials Project

Abstract

Zn2V2O7 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. V5+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of V–O bond distances ranging from 1.73–2.35 Å. Zn2+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Zn–O bond distances ranging from 2.03–2.30 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent V5+ and two equivalent Zn2+ atoms. In the second O2- site, O2- is bonded in a 3-coordinate geometry to one V5+ and two equivalent Zn2+ atoms. In the third O2- site, O2- is bonded in a linear geometry to two equivalent V5+ atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-634381
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; V2Zn2O7; O-V-Zn
OSTI Identifier:
1279458
DOI:
10.17188/1279458

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on V2Zn2O7 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1279458.
Persson, Kristin, & Project, Materials. Materials Data on V2Zn2O7 by Materials Project. United States. doi:10.17188/1279458.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on V2Zn2O7 by Materials Project". United States. doi:10.17188/1279458. https://www.osti.gov/servlets/purl/1279458. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1279458,
title = {Materials Data on V2Zn2O7 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Zn2V2O7 crystallizes in the monoclinic C2/m space group. The structure is three-dimensional. V5+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of V–O bond distances ranging from 1.73–2.35 Å. Zn2+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Zn–O bond distances ranging from 2.03–2.30 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent V5+ and two equivalent Zn2+ atoms. In the second O2- site, O2- is bonded in a 3-coordinate geometry to one V5+ and two equivalent Zn2+ atoms. In the third O2- site, O2- is bonded in a linear geometry to two equivalent V5+ atoms.},
doi = {10.17188/1279458},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

Dataset:

Save / Share: