Inorganic Solid Phases

(Cu,Ag)Pb3Bi5Se11 (CuPb3Bi5Se11) Crystal Structure

General Information

  • Phase Label(s): CuPb3Bi5Se11
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: mS46
  • Space Group: 12
  • Phase Prototype: CuPb2(Pb0.5Bi0.5)2Bi4Se11
  • Measurement Detail(s): Weissenberg photographs (determination of cell and structural parameters), X-rays, Cu Kα (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): selenide
  • Interpretation Detail(s): complete structure determined, least-squares refinement; 443 reflections, R = 0.12
  • Sample Detail(s): pavonite sample from synthetic, sample prepared from Cu1.66Ag0.34PbBi4Se8, EPMA analysis; 45.16 wt.% Bi, 32.59 wt.% Se, 13.48 wt.% Pb, 6.48 wt.% Cu, 2.15 wt.% Ag; multi-phase sample, single crystal (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: CuPb3Bi5Se11
  • Alphabetic Formula: Bi5CuPb3Se11
  • Published Formula: (Cu,Ag)Pb3Bi5Se11
  • Refined Formula: Bi5CuPb3Se11
  • Wyckoff Sequence: 12,i11a
  • Z Formula Units: 2
  • Density: ρ = 7.86 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_1611299

  • 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

    Citation copied