Inorganic Solid Phases

BaPb1−xBixO3, x= 0.25 (BaPb0.75Bi0.25O3 tet, T = 300 K) Crystal Structure

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General Information

  • Phase Label(s): BaPb0.75Bi0.25O3 tet
  • Structure Class(es): perovskite
  • Classification by Properties: ferroelectric FE, metal, nonmetal, superconductor
  • Mineral Name(s): –
  • Pearson Symbol: tI20
  • Space Group: 140
  • Phase Prototype: SrZrO3
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; U.S.A. Maryland, Gaithersburg, NIST Center for Neutron Research, NBSR, BT-1 (determination of structural parameters), neutrons; λ = 0.11968 nm (determination of cell and structural parameters), T = 300 K (determination of cell and structural parameters)
  • Phase Class(es): –
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined; composition dependence studied, Rietveld refinement, multiphase, RP = 0.0956; wRP = 0.118; RB = 0.0638
  • Sample Detail(s): sample prepared from Ba[NO3]2, Pb[NO3]2, Bi2O3, amounts of orthorhombic modification (27 wt.%), powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: BaPb0.75Bi0.25O3
  • Alphabetic Formula: BaBi0.25O3Pb0.75
  • Published Formula: BaPb1−xBixO3, x= 0.25
  • Refined Formula: BaBi0.28O3Pb0.72
  • Wyckoff Sequence: 140,hcba
  • Z Formula Units: 4
  • Density: ρ = 8.29 Mg·m−3
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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_1226980

  • 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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