Materials Data on LuB4 by Materials Project

doi:10.17188/1276288

Title: Materials Data on LuB4 by Materials Project

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Abstract

LuB4 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Lu is bonded in a 4-coordinate geometry to eighteen B atoms. There are a spread of Lu–B bond distances ranging from 2.70–3.04 Å. There are three inequivalent B sites. In the first B site, B is bonded in a 1-coordinate geometry to four equivalent Lu and five B atoms. There is one shorter (1.61 Å) and four longer (1.74 Å) B–B bond length. In the second B site, B is bonded in a 9-coordinate geometry to four equivalent Lu and five B atoms. There is one shorter (1.69 Å) and two longer (1.80 Å) B–B bond length. In the third B site, B is bonded in a distorted trigonal planar geometry to six equivalent Lu and three B atoms. The B–B bond length is 1.72 Å.

Authors:: The Materials Project

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

Other Number(s):: mp-571495

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; LuB4; B-Lu

OSTI Identifier:: 1276288

DOI:: https://doi.org/10.17188/1276288

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                    The Materials Project. Materials Data on LuB4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1276288.

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                    The Materials Project. Materials Data on LuB4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1276288

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                    The Materials Project. 2020.  
"Materials Data on LuB4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1276288.  https://www.osti.gov/servlets/purl/1276288. Pub date:Tue Jul 14 00:00:00 EDT 2020

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@article{osti_1276288,

  title        = {Materials Data on LuB4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {LuB4 crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. Lu is bonded in a 4-coordinate geometry to eighteen B atoms. There are a spread of Lu–B bond distances ranging from 2.70–3.04 Å. There are three inequivalent B sites. In the first B site, B is bonded in a 1-coordinate geometry to four equivalent Lu and five B atoms. There is one shorter (1.61 Å) and four longer (1.74 Å) B–B bond length. In the second B site, B is bonded in a 9-coordinate geometry to four equivalent Lu and five B atoms. There is one shorter (1.69 Å) and two longer (1.80 Å) B–B bond length. In the third B site, B is bonded in a distorted trigonal planar geometry to six equivalent Lu and three B atoms. The B–B bond length is 1.72 Å.},

  doi          = {10.17188/1276288},

  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/10.17188/1276288

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