Inorganic Solid Phases

|Mn37.5|[Si117Al75O384]-FAU, second crystal (Mn11.5Al23Si25O96) Crystal Structure

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General Information

  • Phase Label(s): Mn11.5Al23Si25O96
  • Structure Class(es): zeolite FAU
  • Classification by Properties: –
  • Mineral Name(s): –
  • Pearson Symbol: cF624
  • Space Group: 203
  • Phase Prototype: Ca11.5Al23Si25O96
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; South Korea, Pohang Accelerator Laboratory PAL, PLS reactor, 4A beamline, MXW (determination of structural parameters), X-rays, synchrotron; λ = 0.076999 nm (determination of cell and structural parameters), T = 294(1) K (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; 49 variables; 875 reflections; F > 4σ(F), R = 0.0510; wR = 0.1487
  • Sample Detail(s): sample prepared from Na75Si117Al75O384, Mn[NO3]2[H2O]x, energy-dispersive X-ray analysis; 50.2 at.% Si, 32.1 at.% Al, 17.7 at.% Mn, single crystal (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Mn9.375Al18.75Si29.25O96
  • Alphabetic Formula: Al18.75Mn9.375O96Si29.25
  • Published Formula: |Mn37.5|[Si117Al75O384]-FAU, second crystal
  • Refined Formula: Al18.77Mn9.32O96Si29.23
  • Wyckoff Sequence: 227,ihg3e3c
  • Z Formula Units: 4
  • Density: ρ = 1.50 Mg·m−3
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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

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_1931571

  • 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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