Materials Data on Nb2O5 by Materials Project

doi:10.17188/1187112

Title: Materials Data on Nb2O5 by Materials Project

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Abstract

Nb2O5 crystallizes in the monoclinic C2 space group. The structure is three-dimensional. Nb5+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Nb–O bond distances ranging from 1.90–2.43 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to four equivalent Nb5+ atoms. In the second O2- site, O2- is bonded in a 2-coordinate geometry to three equivalent Nb5+ atoms. In the third O2- site, O2- is bonded in a water-like geometry to two equivalent Nb5+ atoms.

Authors:: The Materials Project

Publication Date:: Thu Jul 16 00:00:00 EDT 2020

Other Number(s):: mp-10426

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; Nb2O5; Nb-O

OSTI Identifier:: 1187112

DOI:: https://doi.org/10.17188/1187112

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                    The Materials Project. Materials Data on Nb2O5 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1187112.

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                    The Materials Project. Materials Data on Nb2O5 by Materials Project.  United States.  doi:https://doi.org/10.17188/1187112

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                    The Materials Project. 2020.  
"Materials Data on Nb2O5 by Materials Project".  United States.  doi:https://doi.org/10.17188/1187112.  https://www.osti.gov/servlets/purl/1187112. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1187112,

  title        = {Materials Data on Nb2O5 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Nb2O5 crystallizes in the monoclinic C2 space group. The structure is three-dimensional. Nb5+ is bonded in a 7-coordinate geometry to seven O2- atoms. There are a spread of Nb–O bond distances ranging from 1.90–2.43 Å. There are three inequivalent O2- sites. In the first O2- site, O2- is bonded in a 4-coordinate geometry to four equivalent Nb5+ atoms. In the second O2- site, O2- is bonded in a 2-coordinate geometry to three equivalent Nb5+ atoms. In the third O2- site, O2- is bonded in a water-like geometry to two equivalent Nb5+ atoms.},

  doi          = {10.17188/1187112},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 16 00:00:00 EDT 2020},

  month        = {Thu Jul 16 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1187112

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