Inorganic Solid Phases

(Na0.60Bi1.40)(Fe1.06Mn0.17Bi0.77)O6.87 (Na0.60Mn0.17Fe1.06Bi2.17O6.87) Crystal Structure

General Information

  • Phase Label(s): Na0.60Mn0.17Fe1.06Bi2.17O6.87
  • Structure Class(es): pyrochlore family
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: cF88
  • Space Group: 227
  • Phase Prototype: Ca2Nb2O7
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; United Kingdom, Chilton-Didcot, Rutherford Appleton Laboratory, ISIS Facility, GEM (determination of structural parameters), X-rays, Cu Kα1 (determination of cell parameters), neutrons, time-of-flight (determination of structural parameters)
  • Phase Class(es):
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined, Rietveld refinement, wRP = 0.04717
  • Sample Detail(s): sample prepared from NaOH, NaBiO3[H2O]2, Fe[NO3]3[H2O]9, MnCl2[H2O]4, inductive coupled plasma method, X-ray fluorescence spectroscopy, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Na0.60Mn0.17Fe1.06Bi2.17O6.87
  • Alphabetic Formula: Bi2.17Fe1.06Mn0.17Na0.60O6.87
  • Published Formula: (Na0.60Bi1.40)(Fe1.06Mn0.17Bi0.77)O6.87
  • Refined Formula: Bi2.10Fe1.25Mn0.17Na0.45O6.87
  • Wyckoff Sequence: 227,hfeda
  • Z Formula Units: 8
  • Density: ρ = 7.01 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

Anisotropic

Site
U11 [nm2]
U22 [nm2]
U33 [nm2]
U12 [nm2]
U13 [nm2]
U23 [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1640955

  • 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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