Inorganic Solid Phases

Ba6Ru2Na2P2O17 (Na2Ba6Ru2P2O17, T = 300 K) Crystal Structure

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General Information

  • Phase Label(s): Na2Ba6Ru2P2O17
  • Structure Class(es): perovskite
  • Classification by Properties: nonmetal
  • Mineral Name(s): –
  • Pearson Symbol: hP58
  • Space Group: 194
  • Phase Prototype: Na2Ba6V2Ru2O17
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Siemens D5000 (determination of structural parameters), X-rays, Cu Kα (determination of cell and structural parameters), T = 300 K (determination of cell and structural parameters)
  • Phase Class(es): –
  • Compound Class(es): phosphate
  • Interpretation Detail(s): complete structure determined, Rietveld refinement; 33 variables; 566 reflections, R = 0.0259; RP = 0.0802; wRP = 0.106; RB = 0.0444
  • Sample Detail(s): sample prepared from BaCO3, Na2CO3, RuO2, [NH4]2HPO4, trace amounts of Ba3[PO4]2, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Na2Ba6Ru2P2O17
  • Alphabetic Formula: Ba6Na2O17P2Ru2
  • Published Formula: Ba6Ru2Na2P2O17
  • Refined Formula: Ba6Na2O17P2Ru2
  • Wyckoff Sequence: 194,k2hf5eba
  • Z Formula Units: 2
  • Density: ρ = 5.54 Mg·m−3
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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_1003183

  • 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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