Materials Data on Sr3P2 by Materials Project

doi:10.17188/1206331

Title: Materials Data on Sr3P2 by Materials Project

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Abstract

Sr3P2 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. there are three inequivalent Sr2+ sites. In the first Sr2+ site, Sr2+ is bonded to five P3- atoms to form a mixture of distorted edge, corner, and face-sharing SrP5 trigonal bipyramids. There are a spread of Sr–P bond distances ranging from 2.98–3.45 Å. In the second Sr2+ site, Sr2+ is bonded in a 5-coordinate geometry to five P3- atoms. There are a spread of Sr–P bond distances ranging from 3.00–3.50 Å. In the third Sr2+ site, Sr2+ is bonded to five P3- atoms to form a mixture of distorted edge, corner, and face-sharing SrP5 trigonal bipyramids. There are a spread of Sr–P bond distances ranging from 3.04–3.43 Å. There are three inequivalent P3- sites. In the first P3- site, P3- is bonded in a 8-coordinate geometry to eight Sr2+ atoms. In the second P3- site, P3- is bonded in a 8-coordinate geometry to eight Sr2+ atoms. In the third P3- site, P3- is bonded in a 7-coordinate geometry to seven Sr2+ atoms.

Authors:: The Materials Project

Publication Date:: Wed Apr 29 00:00:00 EDT 2020

Other Number(s):: mp-32635

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; Sr3P2; P-Sr

OSTI Identifier:: 1206331

DOI:: https://doi.org/10.17188/1206331

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                    The Materials Project. Materials Data on Sr3P2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1206331.

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                    The Materials Project. Materials Data on Sr3P2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1206331

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                    The Materials Project. 2020.  
"Materials Data on Sr3P2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1206331.  https://www.osti.gov/servlets/purl/1206331. Pub date:Wed Apr 29 00:00:00 EDT 2020

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@article{osti_1206331,

  title        = {Materials Data on Sr3P2 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Sr3P2 crystallizes in the tetragonal I-42d space group. The structure is three-dimensional. there are three inequivalent Sr2+ sites. In the first Sr2+ site, Sr2+ is bonded to five P3- atoms to form a mixture of distorted edge, corner, and face-sharing SrP5 trigonal bipyramids. There are a spread of Sr–P bond distances ranging from 2.98–3.45 Å. In the second Sr2+ site, Sr2+ is bonded in a 5-coordinate geometry to five P3- atoms. There are a spread of Sr–P bond distances ranging from 3.00–3.50 Å. In the third Sr2+ site, Sr2+ is bonded to five P3- atoms to form a mixture of distorted edge, corner, and face-sharing SrP5 trigonal bipyramids. There are a spread of Sr–P bond distances ranging from 3.04–3.43 Å. There are three inequivalent P3- sites. In the first P3- site, P3- is bonded in a 8-coordinate geometry to eight Sr2+ atoms. In the second P3- site, P3- is bonded in a 8-coordinate geometry to eight Sr2+ atoms. In the third P3- site, P3- is bonded in a 7-coordinate geometry to seven Sr2+ atoms.},

  doi          = {10.17188/1206331},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Wed Apr 29 00:00:00 EDT 2020},

  month        = {Wed Apr 29 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1206331

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