Inorganic Solid Phases

(Sr0.75Ba0.25)5NiMn3O12 (Ba1.25Sr3.75Mn3NiO12) Crystal Structure

General Information

  • Phase Label(s): Ba1.25Sr3.75Mn3NiO12
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: hP144
  • Space Group: 165
  • Phase Prototype: (Ba0.25Sr0.75)5Mn3NiO12
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Philips X'Pert MPD (determination of structural parameters), X-rays, Cu Kα (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): oxide
  • Interpretation Detail(s): complete structure determined, Rietveld refinement, wRP = 0.18; RB = 0.070
  • Sample Detail(s): sample prepared from SrCO3, BaCO3, MnCO3, NiO, inductive coupled plasma method; 35.88(9) at.% Sr, 17.7(4) at.% Ba, 17.8(4) at.% Mn, 7.0(2) at.% Ni, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Ba1.25Sr3.75Mn3NiO12
  • Alphabetic Formula: Ba1.25Mn3NiO12Sr3.75
  • Published Formula: (Sr0.75Ba0.25)5NiMn3O12
  • Refined Formula: Ba1.25Mn3NiO12Sr3.75
  • Wyckoff Sequence: 165,g9f2d4cba
  • Z Formula Units: 6
  • Density: ρ = 5.49 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_1520467

  • 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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