Materials Data on PrTe2 by Materials Project

doi:10.17188/1314859

Title: Materials Data on PrTe2 by Materials Project

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Abstract

PrTe2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pr4+ is bonded in a 9-coordinate geometry to nine Te2- atoms. There are a spread of Pr–Te bond distances ranging from 3.31–3.38 Å. There are two inequivalent Te2- sites. In the first Te2- site, Te2- is bonded in a 8-coordinate geometry to four equivalent Pr4+ and four equivalent Te2- atoms. All Te–Te bond lengths are 3.20 Å. In the second Te2- site, Te2- is bonded to five equivalent Pr4+ atoms to form a mixture of distorted edge and corner-sharing TePr5 trigonal bipyramids.

Authors:: The Materials Project

Publication Date:: 2020-07-16

Other Number(s):: mp-975652

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; PrTe2; Pr-Te

OSTI Identifier:: 1314859

DOI:: https://doi.org/10.17188/1314859

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                    The Materials Project. Materials Data on PrTe2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1314859.

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                    The Materials Project. Materials Data on PrTe2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1314859

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                    The Materials Project. 2020.  
"Materials Data on PrTe2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1314859.  https://www.osti.gov/servlets/purl/1314859. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1314859,

  title        = {Materials Data on PrTe2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {PrTe2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Pr4+ is bonded in a 9-coordinate geometry to nine Te2- atoms. There are a spread of Pr–Te bond distances ranging from 3.31–3.38 Å. There are two inequivalent Te2- sites. In the first Te2- site, Te2- is bonded in a 8-coordinate geometry to four equivalent Pr4+ and four equivalent Te2- atoms. All Te–Te bond lengths are 3.20 Å. In the second Te2- site, Te2- is bonded to five equivalent Pr4+ atoms to form a mixture of distorted edge and corner-sharing TePr5 trigonal bipyramids.},

  doi          = {10.17188/1314859},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1314859

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