Materials Data on Er4(CoB2)3 by Materials Project

doi:10.17188/1726901

Title: Materials Data on Er4(CoB2)3 by Materials Project

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Abstract

Er4(CoB2)3 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Er3+ sites. In the first Er3+ site, Er3+ is bonded in a 6-coordinate geometry to six equivalent B3- atoms. All Er–B bond lengths are 2.61 Å. In the second Er3+ site, Er3+ is bonded in a 6-coordinate geometry to six equivalent B3- atoms. All Er–B bond lengths are 2.61 Å. There are two inequivalent Co2+ sites. In the first Co2+ site, Co2+ is bonded in a linear geometry to two equivalent Co2+ atoms. Both Co–Co bond lengths are 2.43 Å. In the second Co2+ site, Co2+ is bonded in a 7-coordinate geometry to one Co2+ and six equivalent B3- atoms. All Co–B bond lengths are 2.13 Å. B3- is bonded in a 9-coordinate geometry to four Er3+, two equivalent Co2+, and three equivalent B3- atoms. There is two shorter (1.76 Å) and one longer (1.78 Å) B–B bond length.

Publication Date:: Thu Jul 19 04:00:00 UTC 2018

Other Number(s):: mp-1105098

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; B-Co-Er; Er4(CoB2)3; crystal structure

OSTI Identifier:: 1726901

DOI:: https://doi.org/10.17188/1726901

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                    Materials Data on Er4(CoB2)3 by Materials Project.  United States: N. p., 2018. 
        Web.  doi:10.17188/1726901.

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                    Materials Data on Er4(CoB2)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1726901

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                    2018.  
"Materials Data on Er4(CoB2)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1726901.  https://www.osti.gov/servlets/purl/1726901. Pub date:Thu Jul 19 04:00:00 UTC 2018

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@article{osti_1726901,

  title        = {Materials Data on Er4(CoB2)3 by Materials Project},

  
  abstractNote = {Er4(CoB2)3 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Er3+ sites. In the first Er3+ site, Er3+ is bonded in a 6-coordinate geometry to six equivalent B3- atoms. All Er–B bond lengths are 2.61 Å. In the second Er3+ site, Er3+ is bonded in a 6-coordinate geometry to six equivalent B3- atoms. All Er–B bond lengths are 2.61 Å. There are two inequivalent Co2+ sites. In the first Co2+ site, Co2+ is bonded in a linear geometry to two equivalent Co2+ atoms. Both Co–Co bond lengths are 2.43 Å. In the second Co2+ site, Co2+ is bonded in a 7-coordinate geometry to one Co2+ and six equivalent B3- atoms. All Co–B bond lengths are 2.13 Å. B3- is bonded in a 9-coordinate geometry to four Er3+, two equivalent Co2+, and three equivalent B3- atoms. There is two shorter (1.76 Å) and one longer (1.78 Å) B–B bond length.},

  doi          = {10.17188/1726901},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 19 04:00:00 UTC 2018},

  month        = {Thu Jul 19 04:00:00 UTC 2018}

}

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DOI: https://doi.org/10.17188/1726901

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