Inorganic Solid Phases

Na10.4Ni0.471Al11.6Si12.4O48·xH2O (Na21.2NiAl23.2Si24.8O96[H2O]53) Crystal Structure

General Information

  • Phase Label(s): Na21.2NiAl23.2Si24.8O96[H2O]53
  • Structure Class(es): zeolite LTA
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: cF1312
  • Space Group: 226
  • Phase Prototype: Na21.2NiAl23.2Si24.8O96[H2O]53
  • Measurement Detail(s): automatic diffractometer (determination of cell and structural parameters), X-rays (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, R = 0.037; RP = 0.095; wRP = 0.121; RB = 0.056
  • Sample Detail(s): sample prepared from A zeolite, Ni[NO3]2, ICP atomic emission spectroscopy; 14.2 wt.% Al, 10.8 wt.% Na, 1.25 wt.% Ni, 15.7 wt.% Si, powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Na21.2NiAl23.2Si24.8O96[H2O]53
  • Alphabetic Formula: Al23.2[H2O]53Na21.2NiO96Si24.8
  • Published Formula: Na10.4Ni0.471Al11.6Si12.4O48·xH2O
  • Refined Formula: Al24H106.24Na19.60Ni0.96O149.12Si24
  • Wyckoff Sequence: 226,j3i5g4
  • Z Formula Units: 4
  • Density: ρ = 1.96 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

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1705346

  • 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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