Materials Data on La(ReB)4 by Materials Project

doi:10.17188/1757519

Title: Materials Data on La(ReB)4 by Materials Project

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Abstract

La(ReB)4 crystallizes in the tetragonal P4_2/nmc space group. The structure is three-dimensional. La is bonded in a 12-coordinate geometry to twelve equivalent Re and twelve equivalent B atoms. There are four shorter (3.11 Å) and eight longer (3.23 Å) La–Re bond lengths. There are eight shorter (3.09 Å) and four longer (3.27 Å) La–B bond lengths. Re is bonded in a 5-coordinate geometry to three equivalent La and five equivalent B atoms. There are a spread of Re–B bond distances ranging from 2.23–2.35 Å. B is bonded in a 6-coordinate geometry to three equivalent La, five equivalent Re, and one B atom. The B–B bond length is 1.85 Å.

Authors:: The Materials Project

Publication Date:: 2020-09-03

Other Number(s):: mp-1106361

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; La(ReB)4; B-La-Re

OSTI Identifier:: 1757519

DOI:: https://doi.org/10.17188/1757519

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                    The Materials Project. Materials Data on La(ReB)4 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1757519.

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                    The Materials Project. Materials Data on La(ReB)4 by Materials Project.  United States.  doi:https://doi.org/10.17188/1757519

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                    The Materials Project. 2020.  
"Materials Data on La(ReB)4 by Materials Project".  United States.  doi:https://doi.org/10.17188/1757519.  https://www.osti.gov/servlets/purl/1757519. Pub date:Thu Sep 03 00:00:00 EDT 2020

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@article{osti_1757519,

  title        = {Materials Data on La(ReB)4 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {La(ReB)4 crystallizes in the tetragonal P4_2/nmc space group. The structure is three-dimensional. La is bonded in a 12-coordinate geometry to twelve equivalent Re and twelve equivalent B atoms. There are four shorter (3.11 Å) and eight longer (3.23 Å) La–Re bond lengths. There are eight shorter (3.09 Å) and four longer (3.27 Å) La–B bond lengths. Re is bonded in a 5-coordinate geometry to three equivalent La and five equivalent B atoms. There are a spread of Re–B bond distances ranging from 2.23–2.35 Å. B is bonded in a 6-coordinate geometry to three equivalent La, five equivalent Re, and one B atom. The B–B bond length is 1.85 Å.},

  doi          = {10.17188/1757519},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {9}

}

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DOI: https://doi.org/10.17188/1757519

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