Materials Data on GdCo4B by Materials Project

doi:10.17188/1189488

Title: Materials Data on GdCo4B by Materials Project

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Abstract

GdCo4B crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. there are two inequivalent Gd sites. In the first Gd site, Gd is bonded in a 12-coordinate geometry to twelve equivalent Co and six equivalent B atoms. All Gd–Co bond lengths are 2.90 Å. All Gd–B bond lengths are 2.91 Å. In the second Gd site, Gd is bonded in a 6-coordinate geometry to eighteen Co atoms. There are six shorter (2.91 Å) and twelve longer (3.20 Å) Gd–Co bond lengths. There are two inequivalent Co sites. In the first Co site, Co is bonded in a 12-coordinate geometry to three equivalent Gd and six equivalent Co atoms. All Co–Co bond lengths are 2.45 Å. In the second Co site, Co is bonded in a distorted L-shaped geometry to four Gd, two equivalent Co, and two equivalent B atoms. Both Co–B bond lengths are 2.05 Å. B is bonded in a 6-coordinate geometry to three equivalent Gd and six equivalent Co atoms.

Authors:: The Materials Project

Publication Date:: Wed Jul 15 00:00:00 EDT 2020

Other Number(s):: mp-13268

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; GdCo4B; B-Co-Gd

OSTI Identifier:: 1189488

DOI:: https://doi.org/10.17188/1189488

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                    The Materials Project. Materials Data on GdCo4B by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1189488.

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                    The Materials Project. Materials Data on GdCo4B by Materials Project.  United States.  doi:https://doi.org/10.17188/1189488

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                    The Materials Project. 2020.  
"Materials Data on GdCo4B by Materials Project".  United States.  doi:https://doi.org/10.17188/1189488.  https://www.osti.gov/servlets/purl/1189488. Pub date:Wed Jul 15 00:00:00 EDT 2020

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@article{osti_1189488,

  title        = {Materials Data on GdCo4B by Materials Project},

  author       = {The Materials Project},

  abstractNote = {GdCo4B crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. there are two inequivalent Gd sites. In the first Gd site, Gd is bonded in a 12-coordinate geometry to twelve equivalent Co and six equivalent B atoms. All Gd–Co bond lengths are 2.90 Å. All Gd–B bond lengths are 2.91 Å. In the second Gd site, Gd is bonded in a 6-coordinate geometry to eighteen Co atoms. There are six shorter (2.91 Å) and twelve longer (3.20 Å) Gd–Co bond lengths. There are two inequivalent Co sites. In the first Co site, Co is bonded in a 12-coordinate geometry to three equivalent Gd and six equivalent Co atoms. All Co–Co bond lengths are 2.45 Å. In the second Co site, Co is bonded in a distorted L-shaped geometry to four Gd, two equivalent Co, and two equivalent B atoms. Both Co–B bond lengths are 2.05 Å. B is bonded in a 6-coordinate geometry to three equivalent Gd and six equivalent Co atoms.},

  doi          = {10.17188/1189488},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Jul 15 00:00:00 EDT 2020},

  month        = {Wed Jul 15 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1189488

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