Materials Data on TiSnO3 by Materials Project

doi:10.17188/1289317

Title: Materials Data on TiSnO3 by Materials Project

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Abstract

SnTiO3 is beta Vanadium nitride-derived structured and crystallizes in the trigonal R-3 space group. The structure is two-dimensional and consists of three SnTiO3 sheets oriented in the (0, 0, 1) direction. Ti4+ is bonded to six equivalent O2- atoms to form edge-sharing TiO6 octahedra. There is three shorter (1.96 Å) and three longer (1.99 Å) Ti–O bond length. Sn2+ is bonded in a distorted T-shaped geometry to three equivalent O2- atoms. All Sn–O bond lengths are 2.16 Å. O2- is bonded in a distorted trigonal planar geometry to two equivalent Ti4+ and one Sn2+ atom.

Authors:: The Materials Project

Publication Date:: 2020-07-18

Other Number(s):: mp-754246

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; TiSnO3; O-Sn-Ti

OSTI Identifier:: 1289317

DOI:: https://doi.org/10.17188/1289317

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                    The Materials Project. Materials Data on TiSnO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1289317.

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                    The Materials Project. Materials Data on TiSnO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1289317

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                    The Materials Project. 2020.  
"Materials Data on TiSnO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1289317.  https://www.osti.gov/servlets/purl/1289317. Pub date:Sat Jul 18 00:00:00 EDT 2020

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@article{osti_1289317,

  title        = {Materials Data on TiSnO3 by Materials Project},

  author       = {The Materials Project},

  abstractNote = {SnTiO3 is beta Vanadium nitride-derived structured and crystallizes in the trigonal R-3 space group. The structure is two-dimensional and consists of three SnTiO3 sheets oriented in the (0, 0, 1) direction. Ti4+ is bonded to six equivalent O2- atoms to form edge-sharing TiO6 octahedra. There is three shorter (1.96 Å) and three longer (1.99 Å) Ti–O bond length. Sn2+ is bonded in a distorted T-shaped geometry to three equivalent O2- atoms. All Sn–O bond lengths are 2.16 Å. O2- is bonded in a distorted trigonal planar geometry to two equivalent Ti4+ and one Sn2+ atom.},

  doi          = {10.17188/1289317},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1289317

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