Inorganic Solid Phases

Mg0.808Zn0.002Ti0.004Cr0.125Fe2+0.01Fe3+0.209Ni0.008Al1.774Si0.0010.059O4 (Mg0.808Zn0.002Ti0.004Cr0.125Fe0.219Ni0.008Al1.774Si0.001O4) Crystal Structure

General Information

  • Phase Label(s): Mg0.808Zn0.002Ti0.004Cr0.125Fe0.219Ni0.008Al1.774Si0.001O4
  • Structure Class(es): spinel family
  • Classification by Properties:
  • Mineral Name(s): spinel
  • Pearson Symbol: cF56
  • Space Group: 227
  • Phase Prototype: MgAl2O4
  • Measurement Detail(s): automatic diffractometer (determination of cell and structural parameters), X-rays (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): silicate
  • Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement; 182 reflections, wR = 0.0971
  • Sample Detail(s): spinel group sample from Australia, Victoria, Mt. Leura, sample prepared from spinel, single crystal (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Mg0.808Zn0.002Ti0.004Cr0.125Fe0.219Ni0.008Al1.774Si0.001O4
  • Alphabetic Formula: Al1.774Cr0.125Fe0.219Mg0.808Ni0.008O4Si0.001Ti0.004Zn0.002
  • Published Formula: Mg0.808Zn0.002Ti0.004Cr0.125Fe2+0.01Fe3+0.209Ni0.008Al1.774Si0.0010.059O4
  • Refined Formula: Al1.77Cr0.12Fe0.22Mg0.81Ni0.01O4Si0Ti0Zn0
  • Wyckoff Sequence: 227,ecb
  • Z Formula Units: 8
  • Density: ρ = 3.75 Mg·m−3

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

Displacement Parameters

Isotropic

Site
Published
U [nm2]
Type
Computed
Beq [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1603362

  • 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)

  • Cite this content

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