Inorganic Solid Phases

La1.33LixCrxTi2−xO6, x= 0.44 (Li0.22La0.67Ti0.78Cr0.22O3 ht) Crystal Structure

General Information

  • Phase Label(s): Li0.22La0.67Ti0.78Cr0.22O3 ht
  • Structure Class(es): perovskite
  • Classification by Properties: nonmetal
  • Mineral Name(s):
  • Pearson Symbol: oP20
  • Space Group: 62
  • Phase Prototype: GdFeO3
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; France, Grenoble, Institut Laue-Langevin ILL, D1A (determination of structural parameters), neutrons; λ = 0.19110 nm (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined; composition dependence studied, Rietveld refinement, RP = 0.0720; wRP = 0.102; RB = 0.0687
  • Sample Detail(s): sample prepared from La[NO3]3[H2O]6, LiNO3, C10H14O5Ti, C15H21CrO6, amounts of tetragonal phase, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Li0.22La0.67Ti0.78Cr0.22O3
  • Alphabetic Formula: Cr0.22La0.67Li0.22O3Ti0.78
  • Published Formula: La1.33LixCrxTi2−xO6, x= 0.44
  • Refined Formula: Cr0.22La0.67Li0.22O3Ti0.78
  • Wyckoff Sequence: 62,dc2a
  • Z Formula Units: 4
  • Density: ρ = 5.45 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_1412854

  • 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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