Materials Data on Be3N2 by Materials Project

doi:10.17188/1193064

Title: Materials Data on Be3N2 by Materials Project

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Abstract

Be3N2 is Spinel-derived structured and crystallizes in the cubic Ia-3 space group. The structure is three-dimensional. Be2+ is bonded to four N3- atoms to form a mixture of corner and edge-sharing BeN4 tetrahedra. There are a spread of Be–N bond distances ranging from 1.70–1.79 Å. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded to six equivalent Be2+ atoms to form a mixture of distorted corner and edge-sharing NBe6 octahedra. The corner-sharing octahedra tilt angles range from 59–60°. In the second N3- site, N3- is bonded to six equivalent Be2+ atoms to form a mixture of distorted corner and edge-sharing NBe6 octahedra. The corner-sharing octahedral tilt angles are 59°.

Authors:: The Materials Project

Publication Date:: Wed Jul 22 00:00:00 EDT 2020

Other Number(s):: mp-18337

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; Be3N2; Be-N

OSTI Identifier:: 1193064

DOI:: https://doi.org/10.17188/1193064

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                    The Materials Project. Materials Data on Be3N2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1193064.

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                    The Materials Project. Materials Data on Be3N2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1193064

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                    The Materials Project. 2020.  
"Materials Data on Be3N2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1193064.  https://www.osti.gov/servlets/purl/1193064. Pub date:Wed Jul 22 00:00:00 EDT 2020

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@article{osti_1193064,

  title        = {Materials Data on Be3N2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Be3N2 is Spinel-derived structured and crystallizes in the cubic Ia-3 space group. The structure is three-dimensional. Be2+ is bonded to four N3- atoms to form a mixture of corner and edge-sharing BeN4 tetrahedra. There are a spread of Be–N bond distances ranging from 1.70–1.79 Å. There are two inequivalent N3- sites. In the first N3- site, N3- is bonded to six equivalent Be2+ atoms to form a mixture of distorted corner and edge-sharing NBe6 octahedra. The corner-sharing octahedra tilt angles range from 59–60°. In the second N3- site, N3- is bonded to six equivalent Be2+ atoms to form a mixture of distorted corner and edge-sharing NBe6 octahedra. The corner-sharing octahedral tilt angles are 59°.},

  doi          = {10.17188/1193064},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 22 00:00:00 EDT 2020},

  month        = {Wed Jul 22 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1193064

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