Materials Data on CuN3 by Materials Project

doi:10.17188/1202106

Title: Materials Data on CuN3 by Materials Project

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Abstract

CuN3 crystallizes in the tetragonal I4_1/a space group. The structure is one-dimensional and consists of eight CuN3 ribbons oriented in the (0, 0, 1) direction. Cu1+ is bonded in a linear geometry to two equivalent N+0.33- atoms. Both Cu–N bond lengths are 1.84 Å. There are two inequivalent N+0.33- sites. In the first N+0.33- site, N+0.33- is bonded in a distorted bent 150 degrees geometry to one Cu1+ and one N+0.33- atom. The N–N bond length is 1.18 Å. In the second N+0.33- site, N+0.33- is bonded in a linear geometry to two equivalent N+0.33- atoms.

Authors:: The Materials Project

Publication Date:: Sat May 02 00:00:00 EDT 2020

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)

Contributing Org.:: MIT; UC Berkeley; Duke; U Louvain

OSTI Identifier:: 1202106

Report Number(s):: mp-27954

DOE Contract Number:: AC02-05CH11231; EDCBEE

Resource Type:: Data

Resource Relation:: Related Information: https://materialsproject.org/citing

Country of Publication:: United States

Language:: English

Subject:: 36 MATERIALS SCIENCE; crystal structure; CuN3; Cu-N

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                    The Materials Project. Materials Data on CuN3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1202106.

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                    The Materials Project. Materials Data on CuN3 by Materials Project.  United States.  https://doi.org/10.17188/1202106

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                    The Materials Project. 2020.  
        "Materials Data on CuN3 by Materials Project".  United States.  https://doi.org/10.17188/1202106.  https://www.osti.gov/servlets/purl/1202106.

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@article{osti_1202106,

  title        = {Materials Data on CuN3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CuN3 crystallizes in the tetragonal I4_1/a space group. The structure is one-dimensional and consists of eight CuN3 ribbons oriented in the (0, 0, 1) direction. Cu1+ is bonded in a linear geometry to two equivalent N+0.33- atoms. Both Cu–N bond lengths are 1.84 Å. There are two inequivalent N+0.33- sites. In the first N+0.33- site, N+0.33- is bonded in a distorted bent 150 degrees geometry to one Cu1+ and one N+0.33- atom. The N–N bond length is 1.18 Å. In the second N+0.33- site, N+0.33- is bonded in a linear geometry to two equivalent N+0.33- atoms.},

  doi          = {10.17188/1202106},

  url          = {https://www.osti.gov/biblio/1202106},
  journal      = {},
number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sat May 02 00:00:00 EDT 2020},

  month        = {Sat May 02 00:00:00 EDT 2020}

}

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