Materials Data on Pr(CoB)4 by Materials Project

doi:10.17188/1314867

Title: Materials Data on Pr(CoB)4 by Materials Project

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Abstract

PrCo4B4 crystallizes in the tetragonal P4_2/n space group. The structure is three-dimensional. Pr3+ is bonded in a 12-coordinate geometry to eight equivalent B3- atoms. All Pr–B bond lengths are 2.82 Å. Co+2.25+ is bonded in a 5-coordinate geometry to five equivalent B3- atoms. There are a spread of Co–B bond distances ranging from 1.99–2.48 Å. B3- is bonded in a 5-coordinate geometry to two equivalent Pr3+, five equivalent Co+2.25+, and one B3- atom. The B–B bond length is 1.79 Å.

Authors:: The Materials Project

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

Other Number(s):: mp-975663

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; Pr(CoB)4; B-Co-Pr

OSTI Identifier:: 1314867

DOI:: https://doi.org/10.17188/1314867

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                    The Materials Project. Materials Data on Pr(CoB)4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1314867.

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                    The Materials Project. Materials Data on Pr(CoB)4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1314867

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                    The Materials Project. 2020.  
"Materials Data on Pr(CoB)4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1314867.  https://www.osti.gov/servlets/purl/1314867. Pub date:Tue Jul 14 00:00:00 EDT 2020

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@article{osti_1314867,

  title        = {Materials Data on Pr(CoB)4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PrCo4B4 crystallizes in the tetragonal P4_2/n space group. The structure is three-dimensional. Pr3+ is bonded in a 12-coordinate geometry to eight equivalent B3- atoms. All Pr–B bond lengths are 2.82 Å. Co+2.25+ is bonded in a 5-coordinate geometry to five equivalent B3- atoms. There are a spread of Co–B bond distances ranging from 1.99–2.48 Å. B3- is bonded in a 5-coordinate geometry to two equivalent Pr3+, five equivalent Co+2.25+, and one B3- atom. The B–B bond length is 1.79 Å.},

  doi          = {10.17188/1314867},

  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/10.17188/1314867

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Materials Data on Pr(CoB)2 by Materials Project

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NdCo4B4 crystallizes in the tetragonal P4_2/n space group. The structure is three-dimensional. Nd2+ is bonded in a 8-coordinate geometry to eight equivalent B+1.50- atoms. There are four shorter (2.82 Å) and four longer (2.83 Å) Nd–B bond lengths. Co1+ is bonded in a 4-coordinate geometry to five equivalent B+1.50- atoms. There are a spread of Co–B bond distances ranging from 2.00–2.49 Å. B+1.50- is bonded in a 5-coordinate geometry to two equivalent Nd2+, five equivalent Co1+, and one B+1.50- atom. The B–B bond length is 1.79 Å.
Materials Data on Dy(CoB)4 by Materials Project

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Dy(CoB)4 crystallizes in the tetragonal P4_2/nmc space group. The structure is three-dimensional. Dy3+ is bonded in a 12-coordinate geometry to twelve equivalent B3- atoms. There are eight shorter (2.87 Å) and four longer (2.89 Å) Dy–B bond lengths. Co+2.25+ is bonded in a 5-coordinate geometry to five equivalent B3- atoms. There are two shorter (2.04 Å) and three longer (2.10 Å) Co–B bond lengths. B3- is bonded in a 6-coordinate geometry to three equivalent Dy3+, five equivalent Co+2.25+, and one B3- atom. The B–B bond length is 1.75 Å.

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