Inorganic Solid Phases

Bi1/3Pb1/6Zr2(PO4)8/3(SiO4)1/3 (Zr4Pb0.33Bi0.67[SiO4]0.67[PO4]5.33) Crystal Structure

General Information

  • Phase Label(s): Zr4Pb0.33Bi0.67[SiO4]0.67[PO4]5.33
  • Structure Class(es): Nasicon family
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: hR105
  • Space Group: 148
  • Phase Prototype: CaTi4[PO4]6
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Seifert XRD-3000 TT (determination of structural parameters), X-rays, Cu Kα (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): orthophosphate, orthosilicate
  • Interpretation Detail(s): complete structure determined, Rietveld refinement; 1049 reflections, RP = 0.08; wRP = 0.10; RB = 0.10
  • Sample Detail(s): powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Zr4Pb0.33Bi0.67[SiO4]0.67[PO4]5.33
  • Alphabetic Formula: Bi0.67[PO4]5.33Pb0.33[SiO4]0.67Zr4
  • Published Formula: Bi1/3Pb1/6Zr2(PO4)8/3(SiO4)1/3
  • Refined Formula: Bi0.67O24P5.33Pb0.33Si0.67Zr4
  • Wyckoff Sequence: 148,f5c2a
  • Z Formula Units: 3
  • Density: ρ = 3.71 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_1411840

  • 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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