Inorganic Solid Phases

LIT-type zeolite, Si8.736Al3.264O26H2K5.26 (HK3Al2Si4O13) Crystal Structure

General Information

  • Phase Label(s): HK3Al2Si4O13
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s): lithosite
  • Pearson Symbol: mP88
  • Space Group: 4
  • Phase Prototype: HK3Al2Si4O13
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Bruker AXS D8 ADVANCE (determination of structural parameters), X-rays, Cu Kα1; λ = 0.154059 nm (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): silicate
  • Interpretation Detail(s): complete structure determined, Rietveld refinement; 142 variables, wRP = 0.030; RB = 0.018
  • Sample Detail(s): sample prepared from AlCl3[H2O]6, silica, NH4OH, KOH, chemical analysis; Al7.10Si19.19K16.46O57.26, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: HK2.63Al1.63Si4.37O13
  • Alphabetic Formula: Al1.63HK2.63O13Si4.37
  • Published Formula: LIT-type zeolite, Si8.736Al3.264O26H2K5.26
  • Refined Formula: Al1.63HK2.93O13Si4.37
  • Wyckoff Sequence: 4,a44
  • Z Formula Units: 4
  • Density: ρ = 2.44 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_1230631

  • 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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