Materials Data on W3N4 by Materials Project

doi:10.17188/1282201

Title: Materials Data on W3N4 by Materials Project

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Abstract

W3N4 crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. W4+ is bonded to six N3- atoms to form a mixture of corner and edge-sharing WN6 octahedra. The corner-sharing octahedral tilt angles are 0°. All W–N bond lengths are 2.11 Å. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded to six equivalent W4+ atoms to form corner-sharing NW6 octahedra. The corner-sharing octahedral tilt angles are 0°. In the second N3- site, N3- is bonded in a square co-planar geometry to four equivalent W4+ atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-16

Other Number(s):: mp-8102

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; W3N4; N-W

OSTI Identifier:: 1282201

DOI:: https://doi.org/10.17188/1282201

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                    The Materials Project. Materials Data on W3N4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1282201.

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                    The Materials Project. Materials Data on W3N4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1282201

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                    The Materials Project. 2020.  
"Materials Data on W3N4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1282201.  https://www.osti.gov/servlets/purl/1282201. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1282201,

  title        = {Materials Data on W3N4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {W3N4 crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. W4+ is bonded to six N3- atoms to form a mixture of corner and edge-sharing WN6 octahedra. The corner-sharing octahedral tilt angles are 0°. All W–N bond lengths are 2.11 Å. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded to six equivalent W4+ atoms to form corner-sharing NW6 octahedra. The corner-sharing octahedral tilt angles are 0°. In the second N3- site, N3- is bonded in a square co-planar geometry to four equivalent W4+ atoms.},

  doi          = {10.17188/1282201},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1282201

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