Materials Data on Sb2S2O9 by Materials Project

doi:10.17188/1279782

Title: Materials Data on Sb2S2O9 by Materials Project

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Abstract

Sb2S2O9 crystallizes in the tetragonal P4_12_12 space group. The structure is three-dimensional. Sb3+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Sb–O bond distances ranging from 1.95–2.58 Å. S6+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.48 Å) and two longer (1.51 Å) S–O bond length. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one Sb3+ and one S6+ atom. In the second O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Sb3+ and one S6+ atom. In the third O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Sb3+ and one S6+ atom. In the fourth O2- site, O2- is bonded in a distorted single-bond geometry to one Sb3+ and one S6+ atom. In the fifth O2- site, O2- is bonded in a distorted bent 150 degrees geometry to two equivalent Sb3+ atoms.

Authors:: The Materials Project

Publication Date:: Sun May 03 00:00:00 EDT 2020

Other Number(s):: mp-638424

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; Sb2S2O9; O-S-Sb

OSTI Identifier:: 1279782

DOI:: https://doi.org/10.17188/1279782

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                    The Materials Project. Materials Data on Sb2S2O9 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1279782.

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                    The Materials Project. Materials Data on Sb2S2O9 by Materials Project.  United States.  doi:https://doi.org/10.17188/1279782

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                    The Materials Project. 2020.  
"Materials Data on Sb2S2O9 by Materials Project".  United States.  doi:https://doi.org/10.17188/1279782.  https://www.osti.gov/servlets/purl/1279782. Pub date:Sun May 03 00:00:00 EDT 2020

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@article{osti_1279782,

  title        = {Materials Data on Sb2S2O9 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {Sb2S2O9 crystallizes in the tetragonal P4_12_12 space group. The structure is three-dimensional. Sb3+ is bonded in a 5-coordinate geometry to five O2- atoms. There are a spread of Sb–O bond distances ranging from 1.95–2.58 Å. S6+ is bonded in a tetrahedral geometry to four O2- atoms. There is two shorter (1.48 Å) and two longer (1.51 Å) S–O bond length. There are five inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted single-bond geometry to one Sb3+ and one S6+ atom. In the second O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Sb3+ and one S6+ atom. In the third O2- site, O2- is bonded in a distorted bent 150 degrees geometry to one Sb3+ and one S6+ atom. In the fourth O2- site, O2- is bonded in a distorted single-bond geometry to one Sb3+ and one S6+ atom. In the fifth O2- site, O2- is bonded in a distorted bent 150 degrees geometry to two equivalent Sb3+ atoms.},

  doi          = {10.17188/1279782},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {Sun May 03 00:00:00 EDT 2020},

  month        = {Sun May 03 00:00:00 EDT 2020}

}

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DOI: https://doi.org/10.17188/1279782

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