Inorganic Solid Phases

Ba0.5Bi0.9V8O16 (Ba0.5V4Bi0.5O8) Crystal Structure

General Information

  • Phase Label(s): Ba0.5V4Bi0.5O8
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: tI30
  • Space Group: 87
  • Phase Prototype: K0.6Ba0.2(Mg0.02Ti0.84Fe0.14)4O8
  • Measurement Detail(s): automatic diffractometer; Siemens AED2 (determination of structural parameters), X-rays, Mo Kα (determination of structural parameters)
  • Phase Class(es):
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined, least-squares refinement; 26 variables; 505 reflections, R = 0.050; wR = 0.115
  • Sample Detail(s): sample prepared from Ba2V2O7, V2O3, Bi2O3, energy-dispersive X-ray analysis; Ba/Bi/V ratio 0.5/1/8, single crystal (determination of structural parameters)

Substance Summary

  • Standard Formula: Ba0.25V4Bi0.45O8
  • Alphabetic Formula: Ba0.25Bi0.45O8V4
  • Published Formula: Ba0.5Bi0.9V8O16
  • Refined Formula: Ba0.25Bi0.45O8V4
  • Wyckoff Sequence: 87,h3ea
  • Z Formula Units: 2
  • Density: ρ = 5.34 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_1709874

  • 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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