Materials Data on Zn(FeO2)2 by Materials Project

doi:10.17188/1194233

Title: Materials Data on Zn(FeO2)2 by Materials Project

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Abstract

ZnFe2O4 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Fe3+ is bonded to six equivalent O2- atoms to form FeO6 octahedra that share corners with six equivalent ZnO4 tetrahedra and edges with six equivalent FeO6 octahedra. All Fe–O bond lengths are 2.05 Å. Zn2+ is bonded to four equivalent O2- atoms to form ZnO4 tetrahedra that share corners with twelve equivalent FeO6 octahedra. The corner-sharing octahedral tilt angles are 58°. All Zn–O bond lengths are 2.00 Å. O2- is bonded to three equivalent Fe3+ and one Zn2+ atom to form a mixture of distorted edge and corner-sharing OZnFe3 trigonal pyramids.

Publication Date:: 2020-07-13

Other Number(s):: mp-19313

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; crystal structure; Fe-O-Zn; Zn(FeO2)2

OSTI Identifier:: 1194233

DOI:: https://doi.org/10.17188/1194233

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                    Materials Data on Zn(FeO2)2 by Materials Project.  United States: N. p., 2020. 
        Web.  doi:10.17188/1194233.

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                    Materials Data on Zn(FeO2)2 by Materials Project.  United States.  doi:https://doi.org/10.17188/1194233

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                    2020.  
"Materials Data on Zn(FeO2)2 by Materials Project".  United States.  doi:https://doi.org/10.17188/1194233.  https://www.osti.gov/servlets/purl/1194233. Pub date:Mon Jul 13 20:00:00 EDT 2020

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@article{osti_1194233,

  title        = {Materials Data on Zn(FeO2)2 by Materials Project},

  
  abstractNote = {ZnFe2O4 is Spinel structured and crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. Fe3+ is bonded to six equivalent O2- atoms to form FeO6 octahedra that share corners with six equivalent ZnO4 tetrahedra and edges with six equivalent FeO6 octahedra. All Fe–O bond lengths are 2.05 Å. Zn2+ is bonded to four equivalent O2- atoms to form ZnO4 tetrahedra that share corners with twelve equivalent FeO6 octahedra. The corner-sharing octahedral tilt angles are 58°. All Zn–O bond lengths are 2.00 Å. O2- is bonded to three equivalent Fe3+ and one Zn2+ atom to form a mixture of distorted edge and corner-sharing OZnFe3 trigonal pyramids.},

  doi          = {10.17188/1194233},

  journal      = {},

  number       = ,

  volume       = ,

  place        = {United States},

  year         = {2020},

  month        = {7}

}

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DOI: https://doi.org/10.17188/1194233

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