Inorganic Solid Phases

K1.81Na0.09H0.10ZrSi3O9 (H0.10K1.81Na0.09ZrSi3O9) Crystal Structure

General Information

  • Phase Label(s): H0.10K1.81Na0.09ZrSi3O9
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: hR90
  • Space Group: 146
  • Phase Prototype: K2TiSi3O9
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Oxford Diffraction Xcalibur S (determination of structural parameters), X-rays, Mo Kα; λ = 0.071073 nm (determination of cell and structural parameters), T = 293 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): silicate
  • Interpretation Detail(s): positions of non-H atoms determined, full-matrix least-squares refinement; 95 variables; 1765 reflections; I > 2σ(I), R = 0.0526; wR = 0.1151
  • Sample Detail(s): sample prepared from Na1.78K0.06Mn0.03Ba0.01Zr0.99Nb0.02Si3O8.99[H2O]2.92, KCl, electron microprobe analysis, single crystal (determination of cell parameters), single crystal, 0.08×0.12×0.20 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: H0.10K1.81Na0.09ZrSi3O9
  • Alphabetic Formula: H0.10K1.81Na0.09O9Si3Zr
  • Published Formula: K1.81Na0.09H0.10ZrSi3O9
  • Refined Formula: K1.81Na0.09O9Si3Zr
  • Wyckoff Sequence: 146,b9a3
  • Z Formula Units: 6
  • Density: ρ = 2.80 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_1630300

  • 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