Inorganic Solid Phases

La1.75Nd0.1Ca0.064Ba0.086CuO4 (Ba0.094Ca0.056CuLa1.7Nd0.15O4 lt, T = 5 K) Crystal Structure

General Information

  • Phase Label(s): Ba0.094Ca0.056CuLa1.7Nd0.15O4 lt
  • Structure Class(es): high-Tc cuprate family
  • Classification by Properties: superconductor
  • Mineral Name(s):
  • Pearson Symbol: oS28
  • Space Group: 64
  • Phase Prototype: CuLa2O4
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; France, Grenoble, Institut Laue-Langevin ILL, D2B (determination of structural parameters), neutrons; λ = 0.1594 nm (determination of cell and structural parameters), T = 5 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined, Rietveld refinement, wRP = 0.0432
  • Sample Detail(s): amounts of LTO2 phase (18 wt.%), powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Ba0.086Ca0.064CuLa1.75Nd0.1O4
  • Alphabetic Formula: Ba0.086Ca0.064CuLa1.75Nd0.1O4
  • Published Formula: La1.75Nd0.1Ca0.064Ba0.086CuO4
  • Refined Formula: Ba0.09Ca0.06CuLa1.75Nd0.10O4
  • Wyckoff Sequence: 64,f2ea
  • Z Formula Units: 4
  • Density: ρ = 7.05 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_1816204

  • 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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