Inorganic Solid Phases

La1.5Mg0.5Ni7D8.9 (Mg0.5La1.5Ni7D9 hex) Crystal Structure

General Information

  • Phase Label(s): Mg0.5La1.5Ni7D9 hex
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: hP122
  • Space Group: 194
  • Phase Prototype: (Mg0.5La0.5)LaNi7H9.1
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Sweden, Studsvik Neutron Research Laboratory, R2 reactor, SLAD (determination of structural parameters), neutrons; λ = 0.1551 nm (determination of cell and structural parameters), p = 0.0001 GPa (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): deuteride
  • Interpretation Detail(s): complete structure determined, Rietveld refinement, RP = 0.0343; wRP = 0.0402
  • Sample Detail(s): sample prepared from Mg0.5La1.5Ni7, D2, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Mg0.5La1.5Ni7D8.9
  • Alphabetic Formula: D8.9La1.5Mg0.5Ni7
  • Published Formula: La1.5Mg0.5Ni7D8.9
  • Refined Formula: D8.85La1.50Mg0.50Ni7
  • Wyckoff Sequence: 194,k7h2f4e2a
  • Z Formula Units: 4
  • Density: ρ = 6.50 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_1221000

  • 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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