Materials Data on Mg3V by Materials Project

doi:10.17188/1663926

Title: Materials Data on Mg3V by Materials Project

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Abstract

Mg3V is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a distorted body-centered cubic geometry to four equivalent Mg and four equivalent V atoms. All Mg–Mg bond lengths are 2.98 Å. All Mg–V bond lengths are 2.98 Å. In the second Mg site, Mg is bonded in a 8-coordinate geometry to eight equivalent Mg and six equivalent V atoms. All Mg–V bond lengths are 3.44 Å. V is bonded in a distorted body-centered cubic geometry to fourteen Mg atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1185800

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; Mg3V; Mg-V

OSTI Identifier:: 1663926

DOI:: https://doi.org/10.17188/1663926

Citation Formats


                    The Materials Project. Materials Data on Mg3V by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1663926.

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                    The Materials Project. Materials Data on Mg3V by Materials Project.  United States.  doi:https://doi.org/10.17188/1663926

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                    The Materials Project. 2020.  
"Materials Data on Mg3V by Materials Project".  United States.  doi:https://doi.org/10.17188/1663926.  https://www.osti.gov/servlets/purl/1663926. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1663926,

  title        = {Materials Data on Mg3V by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Mg3V is alpha bismuth trifluoride structured and crystallizes in the cubic Fm-3m space group. The structure is three-dimensional. there are two inequivalent Mg sites. In the first Mg site, Mg is bonded in a distorted body-centered cubic geometry to four equivalent Mg and four equivalent V atoms. All Mg–Mg bond lengths are 2.98 Å. All Mg–V bond lengths are 2.98 Å. In the second Mg site, Mg is bonded in a 8-coordinate geometry to eight equivalent Mg and six equivalent V atoms. All Mg–V bond lengths are 3.44 Å. V is bonded in a distorted body-centered cubic geometry to fourteen Mg atoms.},

  doi          = {10.17188/1663926},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1663926

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