Materials Data on I3N by Materials Project

doi:10.17188/1653129

Title: Materials Data on I3N by Materials Project

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Abstract

I3(N) crystallizes in the orthorhombic Pnma space group. The structure is one-dimensional and consists of four jodamin molecules and two I ribbons oriented in the (0, 1, 0) direction. In each I ribbon, there are two inequivalent I1- sites. In the first I1- site, I1- is bonded in a linear geometry to two equivalent I1- atoms. There are one shorter (2.91 Å) and one longer (2.97 Å) I–I bond lengths. In the second I1- site, I1- is bonded in a distorted water-like geometry to two equivalent I1- atoms.

Authors:: The Materials Project

Publication Date:: 2020-07-23

Other Number(s):: mp-1190039

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; I3N; I-N

OSTI Identifier:: 1653129

DOI:: https://doi.org/10.17188/1653129

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                    The Materials Project. Materials Data on I3N by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1653129.

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                    The Materials Project. Materials Data on I3N by Materials Project.  United States.  doi:https://doi.org/10.17188/1653129

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                    The Materials Project. 2020.  
"Materials Data on I3N by Materials Project".  United States.  doi:https://doi.org/10.17188/1653129.  https://www.osti.gov/servlets/purl/1653129. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1653129,

  title        = {Materials Data on I3N by Materials Project},

  author       = {The Materials Project},

  abstractNote = {I3(N) crystallizes in the orthorhombic Pnma space group. The structure is one-dimensional and consists of four jodamin molecules and two I ribbons oriented in the (0, 1, 0) direction. In each I ribbon, there are two inequivalent I1- sites. In the first I1- site, I1- is bonded in a linear geometry to two equivalent I1- atoms. There are one shorter (2.91 Å) and one longer (2.97 Å) I–I bond lengths. In the second I1- site, I1- is bonded in a distorted water-like geometry to two equivalent I1- atoms.},

  doi          = {10.17188/1653129},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1653129

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