Inorganic Solid Phases

Li-philllipsite; (Ca0.28Na0.31K0.15Ba0.02Li4.87)[Al5.78Si10.17O32)·13.92H2O (K0.1Na0.3Li4.8Ca0.3Al5.8Si10.2O32[H2O]13.9) Crystal Structure

General Information

  • Phase Label(s): K0.1Na0.3Li4.8Ca0.3Al5.8Si10.2O32[H2O]13.9
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: mP72
  • Space Group: 11
  • Phase Prototype: K0.1Na0.3Li4.8Ca0.3(Al0.36Si0.64)16O32[H2O]13.9
  • Measurement Detail(s): automatic diffractometer (determination of cell and 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, Rietveld refinement; 102 variables; 697 reflections, RP = 0.0479; wRP = 0.0645
  • Sample Detail(s): sample prepared from phillipsite -Na, LiCl, atomic absorption spectroscopy, electron microprobe analysis, thermogravimetry; (Ca0.28Na0.31K0.15Ba0.02Li4.87)[Al5.78Si10.17O32)·13.92H2O, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: K0.1Na0.3Li4.8Ca0.3Al5.8Si10.2O32[H2O]13.9
  • Alphabetic Formula: Al5.8Ca0.3[H2O]13.9K0.1Li4.8Na0.3O32Si10.2
  • Published Formula: Li-philllipsite; (Ca0.28Na0.31K0.15Ba0.02Li4.87)[Al5.78Si10.17O32)·13.92H2O
  • Refined Formula: Al5.79Ca0.50H26.63K0.15Li4Na0.55O45.31Si10.21
  • Wyckoff Sequence: 11,f15e6
  • Z Formula Units: 1
  • Density: ρ = 2.08 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_1721517

  • 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

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