Materials Data on Sr(AsPd)2 by Materials Project

doi:10.17188/1208106

Title: Materials Data on Sr(AsPd)2 by Materials Project

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Abstract

SrPd2As2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Sr2+ is bonded to eight equivalent As3- atoms to form SrAs8 hexagonal bipyramids that share corners with sixteen equivalent PdAs4 tetrahedra, edges with four equivalent SrAs8 hexagonal bipyramids, edges with eight equivalent PdAs4 tetrahedra, and faces with four equivalent SrAs8 hexagonal bipyramids. All Sr–As bond lengths are 3.39 Å. Pd2+ is bonded to four equivalent As3- atoms to form PdAs4 tetrahedra that share corners with eight equivalent SrAs8 hexagonal bipyramids, corners with four equivalent PdAs4 tetrahedra, edges with four equivalent SrAs8 hexagonal bipyramids, and edges with four equivalent PdAs4 tetrahedra. All Pd–As bond lengths are 2.58 Å. As3- is bonded in a 9-coordinate geometry to four equivalent Sr2+, four equivalent Pd2+, and one As3- atom. The As–As bond length is 2.58 Å.

Authors:: The Materials Project

Publication Date:: Wed May 10 00:00:00 EDT 2017

Other Number(s):: mp-4370

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; Sr(AsPd)2; As-Pd-Sr

OSTI Identifier:: 1208106

DOI:: https://doi.org/10.17188/1208106

Citation Formats


                    The Materials Project. Materials Data on Sr(AsPd)2 by Materials Project.  United States: N. p., 2017. 
        Web.  doi:10.17188/1208106.

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                    The Materials Project. Materials Data on Sr(AsPd)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1208106

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                    The Materials Project. 2017.  
"Materials Data on Sr(AsPd)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1208106.  https://www.osti.gov/servlets/purl/1208106. Pub date:Wed May 10 00:00:00 EDT 2017

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@article{osti_1208106,

  title        = {Materials Data on Sr(AsPd)2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {SrPd2As2 crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Sr2+ is bonded to eight equivalent As3- atoms to form SrAs8 hexagonal bipyramids that share corners with sixteen equivalent PdAs4 tetrahedra, edges with four equivalent SrAs8 hexagonal bipyramids, edges with eight equivalent PdAs4 tetrahedra, and faces with four equivalent SrAs8 hexagonal bipyramids. All Sr–As bond lengths are 3.39 Å. Pd2+ is bonded to four equivalent As3- atoms to form PdAs4 tetrahedra that share corners with eight equivalent SrAs8 hexagonal bipyramids, corners with four equivalent PdAs4 tetrahedra, edges with four equivalent SrAs8 hexagonal bipyramids, and edges with four equivalent PdAs4 tetrahedra. All Pd–As bond lengths are 2.58 Å. As3- is bonded in a 9-coordinate geometry to four equivalent Sr2+, four equivalent Pd2+, and one As3- atom. The As–As bond length is 2.58 Å.},

  doi          = {10.17188/1208106},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed May 10 00:00:00 EDT 2017},

  month        = {Wed May 10 00:00:00 EDT 2017}

}

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DOI: https://doi.org/10.17188/1208106

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