Inorganic Solid Phases

K0.97Na0.03Li0.67Mg2Fe0.33Al0.6Si3.4O10[OH]1.2F0.8 Crystal Structure

General Information

  • Phase Label(s): K0.97Na0.03Li0.67Mg2Fe0.33Al0.6Si3.4O10[OH]1.2F0.8
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s): phlogopite 2O
  • Pearson Symbol: oS80
  • Space Group: 63
  • Phase Prototype: K0.97Na0.03Li0.67Mg2Fe0.33(Al0.15Si0.85)4O10([OH]0.6F0.4)2
  • Measurement Detail(s): automatic diffractometer; 26 (determination of cell parameters), automatic diffractometer; Siemens P4 (determination of structural parameters), X-rays, Mo Kα (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): hydroxide, silicate, fluoride
  • Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement on F2; 926 reflections; F > 4σ(F), R = 0.034; wR = 0.092
  • Sample Detail(s): phlogopite sample from Russia, Kola Peninsula, Khibiny massif, single crystal (determination of cell parameters), single crystal, 0.07×0.16×0.20 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: K0.97Na0.03Li0.67Mg2Fe0.33Al0.6Si3.4O10[OH]1.2F0.8
  • Alphabetic Formula: Al0.6F0.8Fe0.33K0.97Li0.67Mg2Na0.03O10[OH]1.2Si3.4
  • Published Formula: K0.97Na0.03Li0.67Mg2Fe0.33Al0.6Si3.4O10[OH]1.2F0.8
  • Refined Formula: Al0.60F0.80Fe0.33H1.20K0.97Li0.67Mg2Na0.03O11.20Si3.40
  • Wyckoff Sequence: 63,h3f2eca
  • Z Formula Units: 4
  • Density: ρ = 2.86 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_1520640

  • 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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