Inorganic Solid Phases

(Mn1.54Zr0.30Y0.23Mg0.03)2.10(Na1.22K0.360.42)2.00K1.00(Li1.53Zn1.15Fe2+0.31)2.99Si11.98O30.00 (K1.3Na1.2Li1.5Zn1.2Y0.2Zr0.3Mn1.6Fe0.3Si12O30) Crystal Structure

General Information

  • Phase Label(s): K1.3Na1.2Li1.5Zn1.2Y0.2Zr0.3Mn1.6Fe0.3Si12O30
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s): darapiozite
  • Pearson Symbol: hP100
  • Space Group: 192
  • Phase Prototype: KNa0.1Ca2(Be0.7Al0.3)3Si12O30[H2O]0.9
  • Measurement Detail(s): automatic diffractometer; 30 (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): silicate
  • Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement on F2; 44 variables; 447 reflections; F > 4σ(F), R = 0.031
  • Sample Detail(s): darapiosite sample from Tajikistan, Tien-Shan Mountains, Dara-i-Pioz, atomic emission spectroscopy, electron microprobe analysis; (Mn1.54Zr0.30Y0.23Mg0.03)2.10(Na1.22K0.360.42)2.00K1.00(Li1.53Zn1.15Fe2+0.31)2.99Si11.98O30.00, single crystal (determination of cell parameters), single crystal, 0.18×0.32×0.50 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: K1.3Na1.2Li1.5Zn1.2Y0.2Zr0.3Mn1.6Fe0.3Si12O30
  • Alphabetic Formula: Fe0.3K1.3Li1.5Mn1.6Na1.2O30Si12Y0.2Zn1.2Zr0.3
  • Published Formula: (Mn1.54Zr0.30Y0.23Mg0.03)2.10(Na1.22K0.360.42)2.00K1.00(Li1.53Zn1.15Fe2+0.31)2.99Si11.98O30.00
  • Refined Formula: Fe0.31K1.36Li1.54Mn1.50Na1.22O30Si12Y0.22Zn1.15Zr0.28
  • Wyckoff Sequence: 192,m3lfdca
  • Z Formula Units: 2
  • Density: ρ = 2.89 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]

Powder Pattern

published defraction line
d [Å]
computed diffraction line for Cu Kα
d [nm]
intensity
I [1]
h [1]
k [1]
l [1]
Radiation
Remark

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1818950

  • 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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