Materials Data on PuTcB2 by Materials Project

doi:10.17188/1722272

Title: Materials Data on PuTcB2 by Materials Project

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Abstract

PuTcB2 is Magnesium tetraboride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Pu3+ is bonded in a 3-coordinate geometry to one Tc3- and six equivalent B atoms. The Pu–Tc bond length is 2.85 Å. There are a spread of Pu–B bond distances ranging from 2.65–2.75 Å. Tc3- is bonded in a 7-coordinate geometry to one Pu3+ and six equivalent B atoms. There are a spread of Tc–B bond distances ranging from 2.26–2.31 Å. B is bonded in a 8-coordinate geometry to three equivalent Pu3+, three equivalent Tc3-, and two equivalent B atoms. Both B–B bond lengths are 1.81 Å.

Authors:: The Materials Project

Publication Date:: 2020-06-05

Other Number(s):: mp-1188688

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; PuTcB2; B-Pu-Tc

OSTI Identifier:: 1722272

DOI:: https://doi.org/10.17188/1722272

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                    The Materials Project. Materials Data on PuTcB2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1722272.

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                    The Materials Project. Materials Data on PuTcB2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1722272

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                    The Materials Project. 2020.  
"Materials Data on PuTcB2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1722272.  https://www.osti.gov/servlets/purl/1722272. Pub date:Fri Jun 05 00:00:00 EDT 2020

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@article{osti_1722272,

  title        = {Materials Data on PuTcB2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PuTcB2 is Magnesium tetraboride-derived structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Pu3+ is bonded in a 3-coordinate geometry to one Tc3- and six equivalent B atoms. The Pu–Tc bond length is 2.85 Å. There are a spread of Pu–B bond distances ranging from 2.65–2.75 Å. Tc3- is bonded in a 7-coordinate geometry to one Pu3+ and six equivalent B atoms. There are a spread of Tc–B bond distances ranging from 2.26–2.31 Å. B is bonded in a 8-coordinate geometry to three equivalent Pu3+, three equivalent Tc3-, and two equivalent B atoms. Both B–B bond lengths are 1.81 Å.},

  doi          = {10.17188/1722272},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {6}

}

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DOI: https://doi.org/10.17188/1722272

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