Inorganic Solid Phases

(K,Na,Ca)6(Mg,Fe,Mn)24[Si32.5Al7.5]O96(OH)16(H2O)21 (K0.3Na0.4Ca0.3Mn3.9Fe0.1Al1.4Si5.3O16[OH]2.7[H2O]3.5) Crystal Structure

General Information

  • Phase Label(s): K0.3Na0.4Ca0.3Mn3.9Fe0.1Al1.4Si5.3O16[OH]2.7[H2O]3.5
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s): ganophyllite
  • Pearson Symbol: mS224
  • Space Group: 15
  • Phase Prototype: (K0.3Na0.4Ca0.3)(Mn0.975Fe0.075)4(Al0.21Si0.79)6.7O16[OH]2.7[H2O]3.5
  • Measurement Detail(s): automatic diffractometer; 25 (determination of cell parameters), automatic diffractometer; Enraf-Nonius CAD4 (determination of structural parameters), X-rays, Mo Kα (determination of cell and structural parameters), T = 292 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): hydroxide, silicate, hydrate
  • Interpretation Detail(s): positions of non-H atoms in average structure determined, full-matrix least-squares refinement; 2389 reflections; I > 3σ(I), R = 0.041; wR = 0.045
  • Sample Detail(s): ganophyllite sample from U.S.A. New Jersey, Sussex County, Franklin Furnace, energy-dispersive spectroscopy; cation content normalized to 24 Mn: K0.28Na1.63Ca0.98Mn24Fe0.42Al9.64Si36.44; four more analyses performed on the same sample, single crystal (determination of cell parameters), single crystal, 0.12×0.12×0.12 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: K0.3Na0.4Ca0.3Mn3.9Fe0.1Al1.4Si5.3O16[OH]2.7[H2O]3.5
  • Alphabetic Formula: Al1.4Ca0.3Fe0.1[H2O]3.5K0.3Mn3.9Na0.4O16[OH]2.7Si5.3
  • Published Formula: (K,Na,Ca)6(Mg,Fe,Mn)24[Si32.5Al7.5]O96(OH)16(H2O)21
  • Refined Formula: Al1.34H1.82K0.92Mn3.98O19.63Si5.03
  • Wyckoff Sequence: 15,f26e3a
  • Z Formula Units: 4
  • Density: ρ = 2.84 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]

Anisotropic

Site
U11 [nm2]
U22 [nm2]
U33 [nm2]
U12 [nm2]
U13 [nm2]
U23 [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1617585

  • 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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