Inorganic Solid Phases

Na6[Co0.2Zn0.8PO4]6·9H2O (Na2Zn1.6Co0.4[PO4]2[H2O]3) Crystal Structure

General Information

  • Phase Label(s): Na2Zn1.6Co0.4[PO4]2[H2O]3
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: hP102
  • Space Group: 169
  • Phase Prototype: Na2(Zn0.8Co0.2)2[PO4]2[H2O]3
  • Measurement Detail(s): automatic diffractometer; 25 (determination of cell parameters), automatic diffractometer; Enraf-Nonius CAD4 (determination of structural parameters), X-rays, Mo Kα; λ = 0.071069 nm (determination of cell and structural parameters), T = 293(1) K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): orthophosphate, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, full-matrix least-squares refinement; 68 variables; 527 reflections; I > 2.5σ(I), R = 0.070; wR = 0.061
  • Sample Detail(s): sample prepared from Zn(CH3COO), Co(CH3COO), H3PO4, NaOH, inductive coupled plasma method; Zn24Co6P30Na30O165H90, single crystal (determination of cell parameters), single crystal, 0.04×0.06×0.12 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Na2Zn1.6Co0.4[PO4]2[H2O]3
  • Alphabetic Formula: Co0.4[H2O]3Na2[PO4]2Zn1.6
  • Published Formula: Na6[Co0.2Zn0.8PO4]6·9H2O
  • Refined Formula: Co0.40H6Na2O11P2Zn1.60
  • Wyckoff Sequence: 169,a17
  • Z Formula Units: 6
  • Density: ρ = 2.91 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
U [nm2]
Type
Computed
Beq [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1613426

  • 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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