Materials Data on SrFe2AsP by Materials Project

doi:10.17188/1711005

Title: Materials Data on SrFe2AsP by Materials Project

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Abstract

SrFe2AsP is alpha bismuth trifluoride-derived structured and crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Sr2+ is bonded in a body-centered cubic geometry to four equivalent As3- and four equivalent P3- atoms. All Sr–As bond lengths are 3.25 Å. All Sr–P bond lengths are 3.26 Å. Fe2+ is bonded to two equivalent As3- and two equivalent P3- atoms to form a mixture of corner and edge-sharing FeAs2P2 tetrahedra. Both Fe–As bond lengths are 2.32 Å. Both Fe–P bond lengths are 2.20 Å. As3- is bonded in a 8-coordinate geometry to four equivalent Sr2+ and four equivalent Fe2+ atoms. P3- is bonded in a 4-coordinate geometry to four equivalent Sr2+ and four equivalent Fe2+ atoms.

Authors:: The Materials Project

Publication Date:: 2019-01-12

Other Number(s):: mp-1218282

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; SrFe2AsP; As-Fe-P-Sr

OSTI Identifier:: 1711005

DOI:: https://doi.org/10.17188/1711005

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                    The Materials Project. Materials Data on SrFe2AsP by Materials Project.  United States: N. p., 2019. 
        Web.  doi:10.17188/1711005.

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                    The Materials Project. Materials Data on SrFe2AsP by Materials Project.  United States.  doi:https://doi.org/10.17188/1711005

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                    The Materials Project. 2019.  
"Materials Data on SrFe2AsP by Materials Project".  United States.  doi:https://doi.org/10.17188/1711005.  https://www.osti.gov/servlets/purl/1711005. Pub date:Sat Jan 12 00:00:00 EST 2019

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@article{osti_1711005,

  title        = {Materials Data on SrFe2AsP by Materials Project},

  author       = {The Materials Project},

  abstractNote = {SrFe2AsP is alpha bismuth trifluoride-derived structured and crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. Sr2+ is bonded in a body-centered cubic geometry to four equivalent As3- and four equivalent P3- atoms. All Sr–As bond lengths are 3.25 Å. All Sr–P bond lengths are 3.26 Å. Fe2+ is bonded to two equivalent As3- and two equivalent P3- atoms to form a mixture of corner and edge-sharing FeAs2P2 tetrahedra. Both Fe–As bond lengths are 2.32 Å. Both Fe–P bond lengths are 2.20 Å. As3- is bonded in a 8-coordinate geometry to four equivalent Sr2+ and four equivalent Fe2+ atoms. P3- is bonded in a 4-coordinate geometry to four equivalent Sr2+ and four equivalent Fe2+ atoms.},

  doi          = {10.17188/1711005},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2019},

  month        = {1}

}

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DOI: https://doi.org/10.17188/1711005

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