Materials Data on CsMnCr(CN)6 by Materials Project

doi:10.17188/1262735

Title: Materials Data on CsMnCr(CN)6 by Materials Project

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Abstract

CrCsMn(CN)6 crystallizes in the cubic F-43m space group. The structure is three-dimensional and consists of four chrom molecules and one CsMn(CN)6 framework. In the CsMn(CN)6 framework, Cs1+ is bonded in a 12-coordinate geometry to twelve equivalent N3- atoms. All Cs–N bond lengths are 3.86 Å. Mn2+ is bonded in an octahedral geometry to six equivalent N3- atoms. All Mn–N bond lengths are 2.20 Å. C2+ is bonded in a distorted single-bond geometry to one N3- atom. The C–N bond length is 1.17 Å. N3- is bonded in a linear geometry to two equivalent Cs1+, one Mn2+, and one C2+ atom.

Authors:: The Materials Project

Publication Date:: Tue Jul 14 00:00:00 EDT 2020

Other Number(s):: mp-505752

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; CsMnCr(CN)6; C-Cr-Cs-Mn-N

OSTI Identifier:: 1262735

DOI:: https://doi.org/10.17188/1262735

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                    The Materials Project. Materials Data on CsMnCr(CN)6 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1262735.

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                    The Materials Project. Materials Data on CsMnCr(CN)6 by Materials Project.  United States.  doi:https://doi.org/10.17188/1262735

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                    The Materials Project. 2020.  
"Materials Data on CsMnCr(CN)6 by Materials Project".  United States.  doi:https://doi.org/10.17188/1262735.  https://www.osti.gov/servlets/purl/1262735. Pub date:Tue Jul 14 00:00:00 EDT 2020

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@article{osti_1262735,

  title        = {Materials Data on CsMnCr(CN)6 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {CrCsMn(CN)6 crystallizes in the cubic F-43m space group. The structure is three-dimensional and consists of four chrom molecules and one CsMn(CN)6 framework. In the CsMn(CN)6 framework, Cs1+ is bonded in a 12-coordinate geometry to twelve equivalent N3- atoms. All Cs–N bond lengths are 3.86 Å. Mn2+ is bonded in an octahedral geometry to six equivalent N3- atoms. All Mn–N bond lengths are 2.20 Å. C2+ is bonded in a distorted single-bond geometry to one N3- atom. The C–N bond length is 1.17 Å. N3- is bonded in a linear geometry to two equivalent Cs1+, one Mn2+, and one C2+ atom.},

  doi          = {10.17188/1262735},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Tue Jul 14 00:00:00 EDT 2020},

  month        = {Tue Jul 14 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1262735

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