Inorganic Solid Phases

Na22Cs3[CsEu6As6W63O218(H2O)14(OH)4]·CsCl·nH2O (Cs5Na22Eu6W63[AsO3]6ClO200[OH]4[H2O]94, T = 183 K) Crystal Structure

General Information

  • Phase Label(s): Cs5Na22Eu6W63[AsO3]6ClO200[OH]4[H2O]94
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: aP848
  • Space Group: 2
  • Phase Prototype: Cs5Na22Eu6W63[AsO3]6ClO200[OH]4[H2O]94
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Oxford Diffraction Xcalibur (determination of structural parameters), X-rays, Mo Kα; λ = 0.071073 nm (determination of cell and structural parameters), T = 183 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): arsenite, hydroxide, chloride, oxide, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined, full-matrix least-squares refinement on F2; 2102 variables; 19396 reflections; I > 2σ(I), R = 0.0995; wR = 0.1748
  • Sample Detail(s): sample prepared from Na9[B-α-AsW9O33], Eu[NO3]3[H2O]6, chemical analysis; 2.5 wt.% Na, 3.3 wt.% Cs, 2.3 wt.% As, 4.6 wt.% Eu, 59.3 wt.% W, single crystal (determination of cell parameters), single crystal, 0.06×0.09×0.13 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Cs5Na22Eu6W63[AsO3]6ClO200[OH]4[H2O]94
  • Alphabetic Formula: [AsO3]6ClCs5Eu6[H2O]94Na22O200[OH]4W63
  • Published Formula: Na22Cs3[CsEu6As6W63O218(H2O)14(OH)4]·CsCl·nH2O
  • Refined Formula: As6ClCs3.90Eu6H156Na22.50O315.50W63
  • Wyckoff Sequence: 2,i424
  • Z Formula Units: 2
  • Density: ρ = 4.40 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_1125473

  • 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