Materials Data on BeSnP2 by Materials Project

doi:10.17188/1325571

Title: Materials Data on BeSnP2 by Materials Project

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Abstract

BeSnP2 is Chalcopyrite structured and crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. Be2+ is bonded to four equivalent P3- atoms to form BeP4 tetrahedra that share corners with four equivalent BeP4 tetrahedra and corners with eight equivalent SnP4 tetrahedra. All Be–P bond lengths are 2.20 Å. Sn4+ is bonded to four equivalent P3- atoms to form SnP4 tetrahedra that share corners with four equivalent SnP4 tetrahedra and corners with eight equivalent BeP4 tetrahedra. All Sn–P bond lengths are 2.54 Å. P3- is bonded to two equivalent Be2+ and two equivalent Sn4+ atoms to form distorted corner-sharing PBe2Sn2 tetrahedra.

Authors:: The Materials Project

Publication Date:: 2020-07-23

Other Number(s):: mp-1009086

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; BeSnP2; Be-P-Sn

OSTI Identifier:: 1325571

DOI:: https://doi.org/10.17188/1325571

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                    The Materials Project. Materials Data on BeSnP2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1325571.

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                    The Materials Project. Materials Data on BeSnP2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1325571

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                    The Materials Project. 2020.  
"Materials Data on BeSnP2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1325571.  https://www.osti.gov/servlets/purl/1325571. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1325571,

  title        = {Materials Data on BeSnP2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {BeSnP2 is Chalcopyrite structured and crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. Be2+ is bonded to four equivalent P3- atoms to form BeP4 tetrahedra that share corners with four equivalent BeP4 tetrahedra and corners with eight equivalent SnP4 tetrahedra. All Be–P bond lengths are 2.20 Å. Sn4+ is bonded to four equivalent P3- atoms to form SnP4 tetrahedra that share corners with four equivalent SnP4 tetrahedra and corners with eight equivalent BeP4 tetrahedra. All Sn–P bond lengths are 2.54 Å. P3- is bonded to two equivalent Be2+ and two equivalent Sn4+ atoms to form distorted corner-sharing PBe2Sn2 tetrahedra.},

  doi          = {10.17188/1325571},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1325571

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