Inorganic Solid Phases

Nd2Fe12.2Ga1.8BD3.2 (Nd2Fe13GaBD3.7, T = 4 K) Crystal Structure

General Information

  • Phase Label(s): Nd2Fe13GaBD3.7
  • Structure Class(es):
  • Classification by Properties: ferromagnet FM, metal
  • Mineral Name(s):
  • Pearson Symbol: tP112
  • Space Group: 136
  • Phase Prototype: Ce2Fe14BH3.7
  • Measurement Detail(s): Guinier film (determination of cell parameters), automatic diffractometer; France, Grenoble, Institut Laue-Langevin ILL, D2B (determination of structural parameters), X-rays, Fe Kα1; λ = 0.19373 nm (determination of cell parameters), neutrons; λ = 0.159 nm (determination of structural parameters), T = 4 K (determination of structural parameters)
  • Phase Class(es):
  • Compound Class(es): boride, deuteride
  • Interpretation Detail(s): complete structure determined, Rietveld refinement, wRP = 0.068; RB = 0.066
  • Sample Detail(s): sample prepared from Nd2Fe12.2Ga1.8B, D2, thermogravimetry; D content analyzed, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Nd2Fe12.2Ga1.8BD3.2
  • Alphabetic Formula: BD3.2Fe12.2Ga1.8Nd2
  • Published Formula: Nd2Fe12.2Ga1.8BD3.2
  • Refined Formula: BD3.50Fe12.20Ga1.80Nd2
  • Wyckoff Sequence: 136,k4j3g2fe2c
  • Z Formula Units: 4
  • Density: ρ = 7.52 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_1615036

  • 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)

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