Inorganic Solid Phases

Zn0.97Al0.03O (Zn0.955Al0.03O, T = 300 K, p = 11.1(2) GPa) Crystal Structure

General Information

  • Phase Label(s): Zn0.955Al0.03O
  • Structure Class(es): normal adamantane structure
  • Classification by Properties: semiconductor
  • Mineral Name(s):
  • Pearson Symbol: hP4
  • Space Group: 186
  • Phase Prototype: ZnO
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Japan, Aichi, Aichi Science and Technology Foundation, Aichi Synchrotron Radiation Center (determination of structural parameters), X-rays, synchrotron; λ = 0.06191 nm (determination of cell and structural parameters), T = 300 K (determination of cell and structural parameters), p = 11.1(2) GPa (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined; pressure dependence studied, Rietveld refinement, multiphase
  • Sample Detail(s): sample prepared from Zn[NO3]2[H2O]6, Al[NO3]3[H2O]9, CO[NH2]2, energy-dispersive X-ray analysis, inductive coupled plasma method; 3.48 at.% Al; 10 wt.% B1 phase, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Zn0.955Al0.03O
  • Alphabetic Formula: Al0.03OZn0.955
  • Published Formula: Zn0.97Al0.03O
  • Refined Formula: Al0.03OZn0.95
  • Wyckoff Sequence: 186,b2
  • Z Formula Units: 2
  • Density: ρ = 5.83 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

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1042055

  • 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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