Inorganic Solid Phases

Ba2Zn(P3O9)2·10H2O (Ba2ZnP6O18[H2O]10) Crystal Structure

General Information

  • Phase Label(s): Ba2ZnP6O18[H2O]10
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: mS148
  • Space Group: 15
  • Phase Prototype: Ba2ZnP6O18[H2O]10
  • Measurement Detail(s): automatic diffractometer; Philips PW1100 (determination of structural parameters), X-rays, Mo Kα1, Mo Kα2 (determination of structural parameters)
  • Phase Class(es):
  • Compound Class(es): phosphate, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, least-squares refinement; 2898 reflections, R = 0.059
  • Sample Detail(s): single crystal, 0.12×0.12×0.14 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Ba2ZnP6O18[H2O]10
  • Alphabetic Formula: Ba2[H2O]10O18P6Zn
  • Published Formula: Ba2Zn(P3O9)2·10H2O
  • Refined Formula: Ba2H20O28P6Zn
  • Wyckoff Sequence: 15,f18e
  • Z Formula Units: 4
  • Density: ρ = 2.57 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

Anisotropic

Site
β11 [nm2]
β22 [nm2]
β33 [nm2]
β12 [nm2]
β13 [nm2]
β23 [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1900839

  • 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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