Inorganic Solid Phases

LaNi0.8Mo0.2O3 (LaMo0.2Ni0.8O3 rhom, T = 1073 K) Crystal Structure

General Information

  • Phase Label(s): LaMo0.2Ni0.8O3 rhom
  • Structure Class(es): perovskite
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: hR30
  • Space Group: 167
  • Phase Prototype: LaAlO3
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; France, Grenoble, Institut Laue-Langevin ILL, D1A (determination of structural parameters), neutrons; λ = 0.191 nm (determination of cell and structural parameters), T = 1073 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined; temperature dependence studied, Rietveld refinement, multiphase, RP = 0.0260; wRP = 0.0361; RB = 0.0158
  • Sample Detail(s): sample prepared from La2O3, Ni[NO3]2[H2O]6, [NH4]6Mo7O24[H2O]4, amounts of La2MoO6 (9.5 wt.%), NiO(5.1 wt.%), powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: LaMo0.2Ni0.8O3
  • Alphabetic Formula: LaMo0.2Ni0.8O3
  • Published Formula: LaNi0.8Mo0.2O3
  • Refined Formula: La0.98Mo0.12Ni0.88O2.78
  • Wyckoff Sequence: 167,eba
  • Z Formula Units: 6
  • Density: ρ = 6.84 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]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1630063

  • 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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