Title: Materials Data on VZnO3 by Materials Project

Abstract

VZnO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. V4+ is bonded to six equivalent O2- atoms to form VO6 octahedra that share corners with six equivalent VO6 octahedra and faces with eight equivalent ZnO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All V–O bond lengths are 1.89 Å. Zn2+ is bonded to twelve equivalent O2- atoms to form ZnO12 cuboctahedra that share corners with twelve equivalent ZnO12 cuboctahedra, faces with six equivalent ZnO12 cuboctahedra, and faces with eight equivalent VO6 octahedra. All Zn–O bond lengths are 2.67 Å. O2- is bonded in a distorted linear geometry to two equivalent V4+ and four equivalent Zn2+ atoms.

Publication Date:
Other Number(s):
mp-1016931
DOE Contract Number:  
AC02-05CH11231;
Research Org.:
LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
Collaborations:
The Materials Project; MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE; crystal structure; O-V-Zn; VZnO3
OSTI Identifier:
1349449
DOI:
https://doi.org/10.17188/1349449

Citation Formats

Materials Data on VZnO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1349449.
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Materials Data on VZnO3 by Materials Project. United States. doi:https://doi.org/10.17188/1349449
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2020. "Materials Data on VZnO3 by Materials Project". United States. doi:https://doi.org/10.17188/1349449. https://www.osti.gov/servlets/purl/1349449. Pub date:Thu Jul 23 20:00:00 EDT 2020
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@article{osti_1349449,
title = {Materials Data on VZnO3 by Materials Project},
abstractNote = {VZnO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. V4+ is bonded to six equivalent O2- atoms to form VO6 octahedra that share corners with six equivalent VO6 octahedra and faces with eight equivalent ZnO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All V–O bond lengths are 1.89 Å. Zn2+ is bonded to twelve equivalent O2- atoms to form ZnO12 cuboctahedra that share corners with twelve equivalent ZnO12 cuboctahedra, faces with six equivalent ZnO12 cuboctahedra, and faces with eight equivalent VO6 octahedra. All Zn–O bond lengths are 2.67 Å. O2- is bonded in a distorted linear geometry to two equivalent V4+ and four equivalent Zn2+ atoms.},
doi = {10.17188/1349449},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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DOI: https://doi.org/10.17188/1349449
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