Materials Data on Mn3V2Si3 by Materials Project

doi:10.17188/1730713

Title: Materials Data on Mn3V2Si3 by Materials Project

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Abstract

V2Mn3Si3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. V3+ is bonded to six Si4- atoms to form a mixture of distorted corner, edge, and face-sharing VSi6 octahedra. The corner-sharing octahedral tilt angles are 39°. All V–Si bond lengths are 2.51 Å. There are two inequivalent Mn2+ sites. In the first Mn2+ site, Mn2+ is bonded in a distorted pentagonal planar geometry to five Si4- atoms. There are a spread of Mn–Si bond distances ranging from 2.39–2.54 Å. In the second Mn2+ site, Mn2+ is bonded in a distorted pentagonal planar geometry to five Si4- atoms. There are a spread of Mn–Si bond distances ranging from 2.38–2.54 Å. There are two inequivalent Si4- sites. In the first Si4- site, Si4- is bonded in a 9-coordinate geometry to four equivalent V3+ and five Mn2+ atoms. In the second Si4- site, Si4- is bonded in a 9-coordinate geometry to four equivalent V3+ and five Mn2+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-05-03

Other Number(s):: mp-1180331

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; Mn3V2Si3; Mn-Si-V

OSTI Identifier:: 1730713

DOI:: https://doi.org/10.17188/1730713

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                    The Materials Project. Materials Data on Mn3V2Si3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1730713.

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                    The Materials Project. Materials Data on Mn3V2Si3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1730713

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                    The Materials Project. 2020.  
"Materials Data on Mn3V2Si3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1730713.  https://www.osti.gov/servlets/purl/1730713. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1730713,

  title        = {Materials Data on Mn3V2Si3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {V2Mn3Si3 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. V3+ is bonded to six Si4- atoms to form a mixture of distorted corner, edge, and face-sharing VSi6 octahedra. The corner-sharing octahedral tilt angles are 39°. All V–Si bond lengths are 2.51 Å. There are two inequivalent Mn2+ sites. In the first Mn2+ site, Mn2+ is bonded in a distorted pentagonal planar geometry to five Si4- atoms. There are a spread of Mn–Si bond distances ranging from 2.39–2.54 Å. In the second Mn2+ site, Mn2+ is bonded in a distorted pentagonal planar geometry to five Si4- atoms. There are a spread of Mn–Si bond distances ranging from 2.38–2.54 Å. There are two inequivalent Si4- sites. In the first Si4- site, Si4- is bonded in a 9-coordinate geometry to four equivalent V3+ and five Mn2+ atoms. In the second Si4- site, Si4- is bonded in a 9-coordinate geometry to four equivalent V3+ and five Mn2+ atoms.},

  doi          = {10.17188/1730713},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {5}

}

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DOI: https://doi.org/10.17188/1730713

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