Materials Data on ZnSnO3 by Materials Project

doi:10.17188/1349477

Title: Materials Data on ZnSnO3 by Materials Project

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Abstract

ZnSnO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Zn2+ is bonded to twelve equivalent O2- atoms to form ZnO12 cuboctahedra that share corners with twelve equivalent ZnO12 cuboctahedra, faces with six equivalent ZnO12 cuboctahedra, and faces with eight equivalent SnO6 octahedra. All Zn–O bond lengths are 2.85 Å. Sn4+ is bonded to six equivalent O2- atoms to form SnO6 octahedra that share corners with six equivalent SnO6 octahedra and faces with eight equivalent ZnO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Sn–O bond lengths are 2.01 Å. O2- is bonded in a linear geometry to four equivalent Zn2+ and two equivalent Sn4+ atoms.

Publication Date:: 2020-07-23

Other Number(s):: mp-1016902

DOE Contract Number:: AC02-05CH11231

Research Org.:: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)

Sponsoring Org.:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)

Collaborations:: The Materials Project; MIT; UC Berkeley; Duke; U Louvain

Subject:: 36 MATERIALS SCIENCE; O-Sn-Zn; ZnSnO3; crystal structure

OSTI Identifier:: 1349477

DOI:: https://doi.org/10.17188/1349477

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                    Materials Data on ZnSnO3 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1349477.

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                    Materials Data on ZnSnO3 by Materials Project.  United States.  doi:https://doi.org/10.17188/1349477

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                    2020.  
"Materials Data on ZnSnO3 by Materials Project".  United States.  doi:https://doi.org/10.17188/1349477.  https://www.osti.gov/servlets/purl/1349477. Pub date:Thu Jul 23 00:00:00 EDT 2020

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@article{osti_1349477,

  title        = {Materials Data on ZnSnO3 by Materials Project},

  
  abstractNote = {ZnSnO3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Zn2+ is bonded to twelve equivalent O2- atoms to form ZnO12 cuboctahedra that share corners with twelve equivalent ZnO12 cuboctahedra, faces with six equivalent ZnO12 cuboctahedra, and faces with eight equivalent SnO6 octahedra. All Zn–O bond lengths are 2.85 Å. Sn4+ is bonded to six equivalent O2- atoms to form SnO6 octahedra that share corners with six equivalent SnO6 octahedra and faces with eight equivalent ZnO12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Sn–O bond lengths are 2.01 Å. O2- is bonded in a linear geometry to four equivalent Zn2+ and two equivalent Sn4+ atoms.},

  doi          = {10.17188/1349477},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1349477

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