Materials Data on NaU3 by Materials Project

doi:10.17188/1651971

Title: Materials Data on NaU3 by Materials Project

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Abstract

NaU3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Na is bonded to twelve U atoms to form a mixture of face and corner-sharing NaU12 cuboctahedra. There are six shorter (3.19 Å) and six longer (3.31 Å) Na–U bond lengths. There are two inequivalent U sites. In the first U site, U is bonded in a 12-coordinate geometry to four equivalent Na and eight U atoms. There are a spread of U–U bond distances ranging from 2.76–3.60 Å. In the second U site, U is bonded in a 12-coordinate geometry to four equivalent Na and eight equivalent U atoms.

Authors:: The Materials Project

Publication Date:: 2019-01-11

Other Number(s):: mp-1186213

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; NaU3; Na-U

OSTI Identifier:: 1651971

DOI:: https://doi.org/10.17188/1651971

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                    The Materials Project. Materials Data on NaU3 by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1651971.

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                    The Materials Project. Materials Data on NaU3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1651971

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                    The Materials Project. 2019.  
"Materials Data on NaU3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1651971.  https://www.osti.gov/servlets/purl/1651971. Pub date:Fri Jan 11 00:00:00 EST 2019

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@article{osti_1651971,

  title        = {Materials Data on NaU3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {NaU3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Na is bonded to twelve U atoms to form a mixture of face and corner-sharing NaU12 cuboctahedra. There are six shorter (3.19 Å) and six longer (3.31 Å) Na–U bond lengths. There are two inequivalent U sites. In the first U site, U is bonded in a 12-coordinate geometry to four equivalent Na and eight U atoms. There are a spread of U–U bond distances ranging from 2.76–3.60 Å. In the second U site, U is bonded in a 12-coordinate geometry to four equivalent Na and eight equivalent U atoms.},

  doi          = {10.17188/1651971},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1651971

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