Inorganic Solid Phases

Na30Al30Si66O192·98H2O (Na15Al15Si33O96[H2O]49) Crystal Structure

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General Information

  • Phase Label(s): Na15Al15Si33O96[H2O]49
  • Structure Class(es): zeolite KFI
  • Classification by Properties: –
  • Mineral Name(s): –
  • Pearson Symbol: cI304
  • Space Group: 229
  • Phase Prototype: Na15(Al0.31Si0.69)48O96[H2O]49
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Norelco (determination of structural parameters), X-rays, Cu Kα (determination of cell and structural parameters)
  • Phase Class(es): –
  • Compound Class(es): silicate, hydrate
  • Interpretation Detail(s): positions of non-H atoms determined; temperature dependence studied, trial-and-error, R = 0.18
  • Sample Detail(s): zeolite group sample from synthetic, chemical analysis; 49.4 wt.% SiO2, 21.5 wt.% H2O, 18.6 wt.% Al2O3, 10.8 wt.% Na2O, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Na15Al15Si33O96[H2O]49
  • Alphabetic Formula: Al15[H2O]49Na15O96Si33
  • Published Formula: Na30Al30Si66O192·98H2O
  • Refined Formula: Al14.88Na8O96Si33.12
  • Wyckoff Sequence: 229,lk2jif
  • Z Formula Units: 2
  • Density: ρ = 2.06 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_1252661

  • 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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