Inorganic Solid Phases

NdNiIn0.95Al0.05D0.39 (Nd3Ni3Al0.15In2.85D1.56) Crystal Structure

General Information

  • Phase Label(s): Nd3Ni3Al0.15In2.85D1.56
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: hP13
  • Space Group: 189
  • Phase Prototype: U3Ni3Al3H2
  • Measurement Detail(s): automatic diffractometer (determination of structural parameters), neutrons (determination of structural parameters), T = 293 K (determination of structural parameters)
  • Phase Class(es):
  • Compound Class(es): deuteride
  • Interpretation Detail(s): complete structure determined; composition dependence studied, Rietveld refinement, RP = 0.036; wRP = 0.046
  • Sample Detail(s): sample prepared from NdNiIn0.95Al0.5, D2, amounts of γ-NdNiIn0.95Al0.5D1.43 (86.8 wt.%), powder (determination of structural parameters)

Substance Summary

  • Standard Formula: Nd3Ni3Al0.15In2.85D1.17
  • Alphabetic Formula: Al0.15D1.17In2.85Nd3Ni3
  • Published Formula: NdNiIn0.95Al0.05D0.39
  • Refined Formula: Al0.15D1.16In2.85Nd3Ni3
  • Wyckoff Sequence: 189,hgfda
  • Z Formula Units: 1
  • Density: ρ = 7.75 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

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1907714

  • 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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