Inorganic Solid Phases

Na11[Ni3Na(H2O)2(AsW9O34)2]·30.5H2O (Na12W18Ni3[AsO4]2O60[H2O]32.5, T = 123 K) Crystal Structure

General Information

  • Phase Label(s): Na12W18Ni3[AsO4]2O60[H2O]32.5
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: aP272
  • Space Group: 2
  • Phase Prototype: Na12W18Ni3[AsO4]2O60[H2O]32.5
  • Measurement Detail(s): automatic diffractometer; Nonius KAPPA (determination of structural parameters), X-rays, Mo Kα; λ = 0.071073 nm (determination of structural parameters), T = 123 K (determination of structural parameters)
  • Phase Class(es):
  • Compound Class(es): arsenate, oxide, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, full-matrix least-squares refinement; 9176 reflections; I > 2σ(I), R = 0.070
  • Sample Detail(s): sample prepared from NiCl2[H2O]6, NaCl, Na9AsW9O34[H2P]13, chemical analysis; 2.75 wt.% As, 62.5 wt.% W, 3.37 wt.% Ni, 5.53 wt.% Na, single crystal, 0.02×0.04×0.14 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Na12W18Ni3[AsO4]2O60[H2O]32.5
  • Alphabetic Formula: [AsO4]2[H2O]32.5Na12Ni3O60W18
  • Published Formula: Na11[Ni3Na(H2O)2(AsW9O34)2]·30.5H2O
  • Refined Formula: As2H63Na10Ni3O99.50W18
  • Wyckoff Sequence: 2,i136
  • Z Formula Units: 2
  • Density: ρ = 4.07 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]

Anisotropic

Site
U11 [nm2]
U22 [nm2]
U33 [nm2]
U12 [nm2]
U13 [nm2]
U23 [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1905006

  • 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

    Citation copied