Materials Data on V4O9 by Materials Project

doi:10.17188/1318074

Title: Materials Data on V4O9 by Materials Project

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Abstract

V4O9 crystallizes in the tetragonal P4/n space group. The structure is two-dimensional and consists of one V4O9 sheet oriented in the (0, 0, 1) direction. V+4.50+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of V–O bond distances ranging from 1.61–2.10 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted square co-planar geometry to four equivalent V+4.50+ atoms. In the second O2- site, O2- is bonded in a single-bond geometry to one V+4.50+ atom. In the third O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to three equivalent V+4.50+ atoms.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

Other Number(s):: mvc-10961

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; V4O9; O-V

OSTI Identifier:: 1318074

DOI:: https://doi.org/10.17188/1318074

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                    The Materials Project. Materials Data on V4O9 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1318074.

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                    The Materials Project. Materials Data on V4O9 by Materials Project.  United States.  doi:https://doi.org/10.17188/1318074

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                    The Materials Project. 2020.  
"Materials Data on V4O9 by Materials Project".  United States.  doi:https://doi.org/10.17188/1318074.  https://www.osti.gov/servlets/purl/1318074. Pub date:Sat May 02 00:00:00 EDT 2020

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@article{osti_1318074,

  title        = {Materials Data on V4O9 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {V4O9 crystallizes in the tetragonal P4/n space group. The structure is two-dimensional and consists of one V4O9 sheet oriented in the (0, 0, 1) direction. V+4.50+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of V–O bond distances ranging from 1.61–2.10 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted square co-planar geometry to four equivalent V+4.50+ atoms. In the second O2- site, O2- is bonded in a single-bond geometry to one V+4.50+ atom. In the third O2- site, O2- is bonded in a distorted trigonal non-coplanar geometry to three equivalent V+4.50+ atoms.},

  doi          = {10.17188/1318074},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1318074

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