Inorganic Solid Phases

Th8Al4D15.4 (Th2AlD3) Crystal Structure

Get Access CIF Download help (pdf)

General Information

  • Phase Label(s): Th2AlD3
  • Structure Class(es): –
  • Classification by Properties: –
  • Mineral Name(s): –
  • Pearson Symbol: tI28
  • Space Group: 140
  • Phase Prototype: Th2AlH3.85
  • Measurement Detail(s): automatic diffractometer (determination of cell and structural parameters), neutrons; λ = 0.1026 nm (determination of cell and structural parameters), T = 298 K (determination of cell and structural parameters)
  • Phase Class(es): –
  • Compound Class(es): deuteride
  • Interpretation Detail(s): complete structure determined; composition dependence studied; temperature dependence studied, integrated intensity refinement, R = 0.160
  • Sample Detail(s): sample prepared from D2, Th2Al, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Th2AlD3.85
  • Alphabetic Formula: AlD3.85Th2
  • Published Formula: Th8Al4D15.4
  • Refined Formula: AlD3.85Th2
  • Wyckoff Sequence: 140,lha
  • Z Formula Units: 4
  • Density: ρ = 8.68 Mg·m−3
View 3D Interactive Structure

Cite this page

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

Powder Pattern

published defraction line
2θ [°]
computed diffraction line for Cu Kα
d [nm]
intensity
I [1]
h [1]
k [1]
l [1]
Radiation
Remark

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1407101

  • 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

    Download this citation

    Citation copied