Inorganic Solid Phases

Pb0.4Ca0.03Sr0.04U0.5Al0.1V0.2Zn0.3Mn0.3As0.2Nb0.2Sn0.1Y0.2Fe7.1Ti12.3O38 (Zn0.7Y0.2U0.5Ti11.3Nb0.6V0.5Mn0.7Fe5.1Pb0.5O38, T = 130 K) Crystal Structure

General Information

  • Phase Label(s): Zn0.7Y0.2U0.5Ti11.3Nb0.6V0.5Mn0.7Fe5.1Pb0.5O38
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s): senaite
  • Pearson Symbol: hR249
  • Space Group: 148
  • Phase Prototype: Zn0.7Y0.2U0.5Ti11.3Nb0.6V0.5Mn0.7Fe5.1Pb0.5O38
  • Measurement Detail(s): automatic diffractometer; 16 (determination of cell parameters), automatic diffractometer; Enraf-Nonius CAD4 (determination of structural parameters), X-rays, Mo Kα; λ = 0.071069 nm (determination of cell and structural parameters), T = 130 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined; temperature dependence studied, 871 reflections; F > 6σ(F), R = 0.046; wR = 0.035
  • Sample Detail(s): senaite sample from Italy, Alps, Piedmont, Val d'Ossola, Pizzo Cervandone, electron microprobe analysis; Pb0.37Ca0.03Sr0.04U0.48Al0.07V0.20Zn0.27Mn0.28As0.16Nb0.25Sn0.11Y0.23Fe7.12Ti12.32O38, single crystal (determination of cell parameters), single crystal, 0.2×0.3×0.4 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Zn0.7Y0.2U0.5Ti11.3Nb0.6V0.5Mn0.7Fe5.1Pb0.5O38
  • Alphabetic Formula: Fe5.1Mn0.7Nb0.6O38Pb0.5Ti11.3U0.5V0.5Y0.2Zn0.7
  • Published Formula: Pb0.4Ca0.03Sr0.04U0.5Al0.1V0.2Zn0.3Mn0.3As0.2Nb0.2Sn0.1Y0.2Fe7.1Ti12.3O38
  • Refined Formula: Fe8.56O38Pb0.51Ti10.94U0.47
  • Wyckoff Sequence: 148,f12c5a
  • Z Formula Units: 3
  • Density: ρ = 4.61 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
B [nm2]
Type
Computed
Beq [nm2]

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_1617966

  • 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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