Inorganic Solid Phases

K9.1H0.4Al9.5Si14.5O48; K-ZK4(1.5) (H0.4K9.1Al9.5Si14.5O48) Crystal Structure

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General Information

  • Phase Label(s): H0.4K9.1Al9.5Si14.5O48
  • Structure Class(es): zeolite LTA
  • Classification by Properties: –
  • Mineral Name(s): –
  • Pearson Symbol: cP94
  • Space Group: 221
  • Phase Prototype: H0.4K9.1(Al0.40Si0.60)24O48
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; MAC Science MXP3TZ (determination of structural parameters), X-rays, Cu Kα; λ = 0.15418 nm (determination of cell and structural parameters)
  • Phase Class(es): –
  • Compound Class(es): silicate
  • Interpretation Detail(s): positions of non-H atoms determined, Rietveld refinement; 35 variables, wRP = 0.0579; RB = 0.0154
  • Sample Detail(s): sample prepared from Na-ZK4, KCl, inductive coupled plasma method; K9.1H0.4Al9.5Si14.5O48, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: H0.4K9.1Al9.5Si14.5O48
  • Alphabetic Formula: Al9.5H0.4K9.1O48Si14.5
  • Published Formula: K9.1H0.4Al9.5Si14.5O48; K-ZK4(1.5)
  • Refined Formula: Al9.60K8.64O48Si14.40
  • Wyckoff Sequence: 221,mkihg2f
  • Z Formula Units: 1
  • Density: ρ = 1.66 Mg·m−3
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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
B [nm2]
Type
Computed
Beq [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1924991

  • 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)

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