Materials Data on SrMn2O11 by Materials Project

doi:10.17188/1708245

Title: Materials Data on SrMn2O11 by Materials Project

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Abstract

SrMn2O11 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Sr is bonded in a distorted q6 geometry to ten O atoms. There are a spread of Sr–O bond distances ranging from 2.60–2.77 Å. There are two inequivalent Mn sites. In the first Mn site, Mn is bonded in a tetrahedral geometry to four O atoms. There is one shorter (1.61 Å) and three longer (1.62 Å) Mn–O bond length. In the second Mn site, Mn is bonded in a tetrahedral geometry to four O atoms. There is one shorter (1.59 Å) and three longer (1.64 Å) Mn–O bond length. There are five inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one Sr and one Mn atom. In the second O site, O is bonded in a distorted linear geometry to one Sr and one Mn atom. In the third O site, O is bonded in a single-bond geometry to one Sr atom. In the fourth O site, O is bonded in a single-bond geometry to one Mn atom. In the fifth O site, O is bonded in a distorted single-bond geometry to one Sr and one Mn atom.

Authors:: The Materials Project

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

Other Number(s):: mp-1203901

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; SrMn2O11; Mn-O-Sr

OSTI Identifier:: 1708245

DOI:: https://doi.org/10.17188/1708245

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                    The Materials Project. Materials Data on SrMn2O11 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1708245.

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                    The Materials Project. Materials Data on SrMn2O11 by Materials Project.  United States.  doi:https://doi.org/10.17188/1708245

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                    The Materials Project. 2020.  
"Materials Data on SrMn2O11 by Materials Project".  United States.  doi:https://doi.org/10.17188/1708245.  https://www.osti.gov/servlets/purl/1708245. Pub date:Wed Apr 29 00:00:00 EDT 2020

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@article{osti_1708245,

  title        = {Materials Data on SrMn2O11 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {SrMn2O11 crystallizes in the cubic P2_13 space group. The structure is three-dimensional. Sr is bonded in a distorted q6 geometry to ten O atoms. There are a spread of Sr–O bond distances ranging from 2.60–2.77 Å. There are two inequivalent Mn sites. In the first Mn site, Mn is bonded in a tetrahedral geometry to four O atoms. There is one shorter (1.61 Å) and three longer (1.62 Å) Mn–O bond length. In the second Mn site, Mn is bonded in a tetrahedral geometry to four O atoms. There is one shorter (1.59 Å) and three longer (1.64 Å) Mn–O bond length. There are five inequivalent O sites. In the first O site, O is bonded in a single-bond geometry to one Sr and one Mn atom. In the second O site, O is bonded in a distorted linear geometry to one Sr and one Mn atom. In the third O site, O is bonded in a single-bond geometry to one Sr atom. In the fourth O site, O is bonded in a single-bond geometry to one Mn atom. In the fifth O site, O is bonded in a distorted single-bond geometry to one Sr and one Mn atom.},

  doi          = {10.17188/1708245},

  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/10.17188/1708245

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