Inorganic Solid Phases

ZrCr2D2.89 (ZrCr2D3.8 3C rt, p = 0.0020 GPa) Crystal Structure

General Information

  • Phase Label(s): ZrCr2D3.8 3C rt
  • Structure Class(es):
  • Classification by Properties: metal
  • Mineral Name(s):
  • Pearson Symbol: cF152
  • Space Group: 227
  • Phase Prototype: ZrV2H3.7
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; France, Grenoble, Centre d'Etudes Nucléaires CEN, SILOE reactor, DN5 (determination of structural parameters), neutrons; λ = 0.128 nm (determination of cell and structural parameters), T = 290 K (determination of cell and structural parameters), p = 0.0020 GPa (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): deuteride
  • Interpretation Detail(s): complete structure determined, integrated intensity refinement, R = 0.04
  • Sample Detail(s): sample prepared from ZrCr2, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: ZrCr2D2.89
  • Alphabetic Formula: Cr2D2.89Zr
  • Published Formula: ZrCr2D2.89
  • Refined Formula: Cr2D2.89Zr
  • Wyckoff Sequence: 227,gcb
  • Z Formula Units: 8
  • Density: ρ = 6.02 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_1600173

  • 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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