Materials Data on YbCuAs2 by Materials Project

doi:10.17188/1266423

Title: Materials Data on YbCuAs2 by Materials Project

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Abstract

YbCuAs2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Yb3+ is bonded in a 8-coordinate geometry to eight As2- atoms. There are four shorter (3.00 Å) and four longer (3.14 Å) Yb–As bond lengths. Cu1+ is bonded to four equivalent As2- atoms to form a mixture of edge and corner-sharing CuAs4 tetrahedra. All Cu–As bond lengths are 2.46 Å. There are two inequivalent As2- sites. In the first As2- site, As2- is bonded in a 8-coordinate geometry to four equivalent Yb3+ and four equivalent As2- atoms. All As–As bond lengths are 2.80 Å. In the second As2- site, As2- is bonded in a 8-coordinate geometry to four equivalent Yb3+ and four equivalent Cu1+ atoms.

Authors:: The Materials Project

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

Other Number(s):: mp-542132

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; YbCuAs2; As-Cu-Yb

OSTI Identifier:: 1266423

DOI:: https://doi.org/10.17188/1266423

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                    The Materials Project. Materials Data on YbCuAs2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1266423.

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                    The Materials Project. Materials Data on YbCuAs2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1266423

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                    The Materials Project. 2020.  
"Materials Data on YbCuAs2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1266423.  https://www.osti.gov/servlets/purl/1266423. Pub date:Thu Jul 16 00:00:00 EDT 2020

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@article{osti_1266423,

  title        = {Materials Data on YbCuAs2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {YbCuAs2 crystallizes in the tetragonal P4/nmm space group. The structure is three-dimensional. Yb3+ is bonded in a 8-coordinate geometry to eight As2- atoms. There are four shorter (3.00 Å) and four longer (3.14 Å) Yb–As bond lengths. Cu1+ is bonded to four equivalent As2- atoms to form a mixture of edge and corner-sharing CuAs4 tetrahedra. All Cu–As bond lengths are 2.46 Å. There are two inequivalent As2- sites. In the first As2- site, As2- is bonded in a 8-coordinate geometry to four equivalent Yb3+ and four equivalent As2- atoms. All As–As bond lengths are 2.80 Å. In the second As2- site, As2- is bonded in a 8-coordinate geometry to four equivalent Yb3+ and four equivalent Cu1+ atoms.},

  doi          = {10.17188/1266423},

  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/10.17188/1266423

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