Materials Data on Gd4(CoB2)3 by Materials Project

doi:10.17188/1732771

Title: Materials Data on Gd4(CoB2)3 by Materials Project

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Abstract

Gd4(CoB2)3 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Gd3+ sites. In the first Gd3+ site, Gd3+ is bonded in a 6-coordinate geometry to six equivalent B3- atoms. All Gd–B bond lengths are 2.66 Å. In the second Gd3+ site, Gd3+ is bonded in a 6-coordinate geometry to six equivalent B3- atoms. All Gd–B bond lengths are 2.66 Å. There are two inequivalent Co2+ sites. In the first Co2+ site, Co2+ is bonded in a distorted linear geometry to two equivalent Co2+ atoms. Both Co–Co bond lengths are 2.54 Å. In the second Co2+ site, Co2+ is bonded in a 6-coordinate geometry to one Co2+ and six equivalent B3- atoms. All Co–B bond lengths are 2.14 Å. B3- is bonded in a 9-coordinate geometry to four Gd3+, two equivalent Co2+, and three equivalent B3- atoms. There is two shorter (1.77 Å) and one longer (1.78 Å) B–B bond length.

Authors:: The Materials Project

Publication Date:: 2018-07-19

Other Number(s):: mp-1105010

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; Gd4(CoB2)3; B-Co-Gd

OSTI Identifier:: 1732771

DOI:: https://doi.org/10.17188/1732771

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                    The Materials Project. Materials Data on Gd4(CoB2)3 by Materials Project.  United States: N. p., 2018. 
        Web.  doi:10.17188/1732771.

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                    The Materials Project. Materials Data on Gd4(CoB2)3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1732771

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                    The Materials Project. 2018.  
"Materials Data on Gd4(CoB2)3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1732771.  https://www.osti.gov/servlets/purl/1732771. Pub date:Thu Jul 19 00:00:00 EDT 2018

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@article{osti_1732771,

  title        = {Materials Data on Gd4(CoB2)3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Gd4(CoB2)3 crystallizes in the trigonal R-3m space group. The structure is three-dimensional. there are two inequivalent Gd3+ sites. In the first Gd3+ site, Gd3+ is bonded in a 6-coordinate geometry to six equivalent B3- atoms. All Gd–B bond lengths are 2.66 Å. In the second Gd3+ site, Gd3+ is bonded in a 6-coordinate geometry to six equivalent B3- atoms. All Gd–B bond lengths are 2.66 Å. There are two inequivalent Co2+ sites. In the first Co2+ site, Co2+ is bonded in a distorted linear geometry to two equivalent Co2+ atoms. Both Co–Co bond lengths are 2.54 Å. In the second Co2+ site, Co2+ is bonded in a 6-coordinate geometry to one Co2+ and six equivalent B3- atoms. All Co–B bond lengths are 2.14 Å. B3- is bonded in a 9-coordinate geometry to four Gd3+, two equivalent Co2+, and three equivalent B3- atoms. There is two shorter (1.77 Å) and one longer (1.78 Å) B–B bond length.},

  doi          = {10.17188/1732771},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2018},

  month        = {7}

}

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