Materials Data on PuGa by Materials Project

doi:10.17188/1276887

Title: Materials Data on PuGa by Materials Project

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Abstract

PuGa crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Pu sites. In the first Pu site, Pu is bonded in a 5-coordinate geometry to one Pu and eight equivalent Ga atoms. The Pu–Pu bond length is 2.29 Å. There are four shorter (2.93 Å) and four longer (3.25 Å) Pu–Ga bond lengths. In the second Pu site, Pu is bonded in a 8-coordinate geometry to eight equivalent Ga atoms. All Pu–Ga bond lengths are 3.00 Å. Ga is bonded in a 10-coordinate geometry to eight Pu and two equivalent Ga atoms. Both Ga–Ga bond lengths are 2.55 Å.

Authors:: The Materials Project

Publication Date:: Thu Jul 16 00:00:00 EDT 2020

Other Number(s):: mp-581747

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; PuGa; Ga-Pu

OSTI Identifier:: 1276887

DOI:: https://doi.org/10.17188/1276887

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                    The Materials Project. Materials Data on PuGa by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1276887.

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                    The Materials Project. Materials Data on PuGa by Materials Project.  United States.  doi:https://doi.org/10.17188/1276887

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                    The Materials Project. 2020.  
"Materials Data on PuGa by Materials Project".  United States.  doi:https://doi.org/10.17188/1276887.  https://www.osti.gov/servlets/purl/1276887. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1276887,

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

  author       = {The Materials Project},

  abstractNote = {PuGa crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Pu sites. In the first Pu site, Pu is bonded in a 5-coordinate geometry to one Pu and eight equivalent Ga atoms. The Pu–Pu bond length is 2.29 Å. There are four shorter (2.93 Å) and four longer (3.25 Å) Pu–Ga bond lengths. In the second Pu site, Pu is bonded in a 8-coordinate geometry to eight equivalent Ga atoms. All Pu–Ga bond lengths are 3.00 Å. Ga is bonded in a 10-coordinate geometry to eight Pu and two equivalent Ga atoms. Both Ga–Ga bond lengths are 2.55 Å.},

  doi          = {10.17188/1276887},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Thu Jul 16 00:00:00 EDT 2020},

  month        = {Thu Jul 16 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1276887

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