Materials Data on PaP2 by Materials Project

doi:10.17188/1350285

Title: Materials Data on PaP2 by Materials Project

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Abstract

PaP2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pa4+ is bonded in a 9-coordinate geometry to nine P2- atoms. There are a spread of Pa–P bond distances ranging from 2.80–2.92 Å. There are two inequivalent P2- sites. In the first P2- site, P2- is bonded to five equivalent Pa4+ atoms to form a mixture of distorted edge and corner-sharing PPa5 trigonal bipyramids. In the second P2- site, P2- is bonded in a 8-coordinate geometry to four equivalent Pa4+ and four equivalent P2- atoms. All P–P bond lengths are 2.73 Å.

Authors:: The Materials Project

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

Other Number(s):: mp-1019093

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; PaP2; P-Pa

OSTI Identifier:: 1350285

DOI:: https://doi.org/10.17188/1350285

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                    The Materials Project. Materials Data on PaP2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1350285.

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                    The Materials Project. Materials Data on PaP2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1350285

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                    The Materials Project. 2020.  
"Materials Data on PaP2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1350285.  https://www.osti.gov/servlets/purl/1350285. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1350285,

  title        = {Materials Data on PaP2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PaP2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pa4+ is bonded in a 9-coordinate geometry to nine P2- atoms. There are a spread of Pa–P bond distances ranging from 2.80–2.92 Å. There are two inequivalent P2- sites. In the first P2- site, P2- is bonded to five equivalent Pa4+ atoms to form a mixture of distorted edge and corner-sharing PPa5 trigonal bipyramids. In the second P2- site, P2- is bonded in a 8-coordinate geometry to four equivalent Pa4+ and four equivalent P2- atoms. All P–P bond lengths are 2.73 Å.},

  doi          = {10.17188/1350285},

  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/10.17188/1350285

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