Inorganic Solid Phases

Zn0.9Fe0.1O (Zn0.82Fe0.123O) Crystal Structure

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General Information

  • Phase Label(s): Zn0.82Fe0.123O
  • Structure Class(es): normal adamantane structure
  • Classification by Properties: ferromagnet FM, intermediate valence, semiconductor, spin glass
  • Mineral Name(s): –
  • Pearson Symbol: hP4
  • Space Group: 186
  • Phase Prototype: ZnO
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Philips (determination of structural parameters), X-rays, Cu Kα (determination of cell parameters), X-rays, Cu Kα1 (determination of structural parameters)
  • Phase Class(es): –
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined; composition dependence studied, Rietveld refinement, R = 0.0230; RP = 0.0587; wRP = 0.0760
  • Sample Detail(s): sample prepared from zinc(II) gluconate hydrate, iron(II) gluconate hydrate, X-ray absorption spectroscopy; Fe3+/(Fe2+ + Fe3+) ratio 0.95; presence of charge-compensating defects confirmed by EXAFS, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Zn0.85Fe0.1O
  • Alphabetic Formula: Fe0.1OZn0.85
  • Published Formula: Zn0.9Fe0.1O
  • Refined Formula: Fe0.10OZn0.85
  • Wyckoff Sequence: 186,b2
  • Z Formula Units: 2
  • Density: ρ = 5.37 Mg·m−3
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Crystallographic Data

Cell Parameters

Published Data
Standardized Data
Unit Cell
Niggli-Reduced Cell
Space Group
a
b
c
α
β
γ
a/b
b/c
c/a
V

Atom Coordinates

Standardized

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation
Co-ord. No.
Atomic Env.

Published

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1142937

  • Copyright

    ©Springer & Material Phases Data System (MPDS), Switzerland & National Institute for Materials Science (NIMS), Japan, 2016

  • Chief Editor

    Pierre Villars, Material Phases Data System (MPDS), CH-6354 Vitznau, Switzerland

    villars.mpds@bluewin.ch

  • Credits

    SpringerMaterials Release 2016.

    Data generated pre-2002: © Springer & MPDS & NIMS; post-2001: © Springer & MPDS

    All Rights Reserved. Version 2016.10.

    Project Coordinator: Shuichi Iwata

    Section-Editor: Karin Cenzual (Crystal Structures)

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