Inorganic Solid Phases

Pr0.6La0.1Ca0.3Mn1−xFexO3, x= 0.2 (Ca0.35La0.455Pr0.195Mn0.95Fe0.05O3 rt, T = 300 K) Crystal Structure

General Information

  • Phase Label(s): Ca0.35La0.455Pr0.195Mn0.95Fe0.05O3 rt
  • Structure Class(es): perovskite
  • Classification by Properties: antiferromagnet AFM, nonmetal
  • Mineral Name(s):
  • Pearson Symbol: *
  • Space Group: *
  • Phase Prototype: *
  • Measurement Detail(s): automatic diffractometer (determination of cell and structural parameters), X-rays (determination of cell and structural parameters), T = 300 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined; composition dependence studied, Rietveld refinement, R = 0.0468
  • Sample Detail(s): sample prepared from MnO2, Pr6O11, La2O3, CaO, Fe2O3 (hematite), energy-dispersive X-ray analysis; composition confirmed, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Ca0.3La0.1Pr0.6Mn0.8Fe0.2O3
  • Alphabetic Formula: Ca0.3Fe0.2La0.1Mn0.8O3Pr0.6
  • Published Formula: Pr0.6La0.1Ca0.3Mn1−xFexO3, x= 0.2
  • Refined Formula: Ca0.30Fe0.20La0.10Mn0.80O3Pr0.60
  • Wyckoff Sequence: 62,dc2a
  • Z Formula Units: 4
  • Density: ρ = 6.19 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_1606138

  • 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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