Materials Data on V7O3 by Materials Project
Abstract
V7O3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are four inequivalent V sites. In the first V site, V is bonded in a linear geometry to two equivalent O atoms. Both V–O bond lengths are 2.22 Å. In the second V site, V is bonded in a distorted T-shaped geometry to three O atoms. There are a spread of V–O bond distances ranging from 2.20–2.22 Å. In the third V site, V is bonded in an L-shaped geometry to two O atoms. There are one shorter (2.20 Å) and one longer (2.22 Å) V–O bond lengths. In the fourth V site, V is bonded in a T-shaped geometry to three O atoms. There are one shorter (2.20 Å) and two longer (2.21 Å) V–O bond lengths. There are two inequivalent O sites. In the first O site, O is bonded to six V atoms to form a mixture of edge and corner-sharing OV6 octahedra. The corner-sharing octahedra tilt angles range from 0–3°. In the second O site, O is bonded to six V atoms to form a mixture of edge and corner-sharing OV6 octahedra. The corner-sharing octahedral tilt angles are 3°.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1100921
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- 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)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; V7O3; O-V
- OSTI Identifier:
- 1689619
- DOI:
- https://doi.org/10.17188/1689619
Citation Formats
The Materials Project. Materials Data on V7O3 by Materials Project. United States: N. p., 2018.
Web. doi:10.17188/1689619.
The Materials Project. Materials Data on V7O3 by Materials Project. United States. doi:https://doi.org/10.17188/1689619
The Materials Project. 2018.
"Materials Data on V7O3 by Materials Project". United States. doi:https://doi.org/10.17188/1689619. https://www.osti.gov/servlets/purl/1689619. Pub date:Fri Jul 13 00:00:00 EDT 2018
@article{osti_1689619,
title = {Materials Data on V7O3 by Materials Project},
author = {The Materials Project},
abstractNote = {V7O3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are four inequivalent V sites. In the first V site, V is bonded in a linear geometry to two equivalent O atoms. Both V–O bond lengths are 2.22 Å. In the second V site, V is bonded in a distorted T-shaped geometry to three O atoms. There are a spread of V–O bond distances ranging from 2.20–2.22 Å. In the third V site, V is bonded in an L-shaped geometry to two O atoms. There are one shorter (2.20 Å) and one longer (2.22 Å) V–O bond lengths. In the fourth V site, V is bonded in a T-shaped geometry to three O atoms. There are one shorter (2.20 Å) and two longer (2.21 Å) V–O bond lengths. There are two inequivalent O sites. In the first O site, O is bonded to six V atoms to form a mixture of edge and corner-sharing OV6 octahedra. The corner-sharing octahedra tilt angles range from 0–3°. In the second O site, O is bonded to six V atoms to form a mixture of edge and corner-sharing OV6 octahedra. The corner-sharing octahedral tilt angles are 3°.},
doi = {10.17188/1689619},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Fri Jul 13 00:00:00 EDT 2018},
month = {Fri Jul 13 00:00:00 EDT 2018}
}