Inorganic Solid Phases

Zn₁₃Tl₆₆Si₁₀₀Al₉₂O₃₈₄·2ZnO (Tl_16.5Zn_3.75Al₂₃Si₂₅O_96.5) Crystal Structure

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General Information

Phase Label(s): Tl_16.5Zn_3.75Al₂₃Si₂₅O_96.5
Structure Class(es): zeolite FAU
Classification by Properties: –
Mineral Name(s): –
Pearson Symbol: cF896
Space Group: 203
Phase Prototype: Tl_16.5Zn_3.75Al₂₃Si₂₅O_96.5
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 = 294 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; 382 reflections; I > 3σ(I), R = 0.039; wR = 0.034
Sample Detail(s): zeolite group sample from synthetic, sample prepared from Na₉₂Si₁₀₀Al₉₂O₃₈₄, Zn[NO₃]₂, TlNO₃, single crystal (determination of cell parameters), single crystal, 0.20 mm³ (determination of structural parameters)

Substance Summary

Standard Formula: Tl_16.5Zn_3.75Al₂₃Si₂₅O_96.5
Alphabetic Formula: Al₂₃O_96.5Si₂₅Tl_16.5Zn_3.75
Published Formula: Zn₁₃Tl₆₆Si₁₀₀Al₉₂O₃₈₄·2ZnO
Refined Formula: Al_23.04O₉₆Si_24.96Tl_16.50Zn_3.75
Wyckoff Sequence: 203,g⁸e⁴
Z Formula Units: 4
Density: ρ = 2.76 Mg·m⁻³

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Crystallographic Data

Cell Parameters

	Published Data	Standardized Data
	Published Data	Unit Cell	Niggli-Reduced Cell
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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.
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Published

Site	Element	Wyckoff Symbol	Symmetry	X	Y	Z	Occupation
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Displacement Parameters

Isotropic

Site	Published U [nm²]	Type	Computed B_eq [nm²]
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Anisotropic

Site	U₁₁ [nm²]	U₂₂ [nm²]	U₃₃ [nm²]	2U₁₂ [nm²]	2U₁₃ [nm²]	2U₂₃ [nm²]
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Experimental Details

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Reference

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3D Interactive Structure

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About this content

Database name

PAULING FILE Multinaries Edition – 2012

Dataset ID

sd_1613038

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.

Project Coordinator: Shuichi Iwata

Section-Editor: Karin Cenzual (Crystal Structures)

Cite this content

Pierre Villars (Chief Editor), PAULING FILE in: Inorganic Solid Phases, SpringerMaterials (online database), Springer, Heidelberg (ed.) SpringerMaterials Zn13Tl66Si100Al92O384·2ZnO (Tl16.5Zn3.75Al23Si25O96.5) Crystal Structure sd_1613038 (Springer-Verlag GmbH, Heidelberg, © 2016)

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Zn13Tl66Si100Al92O384·2ZnO (Tl16.5Zn3.75Al23Si25O96.5) Crystal Structure

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General Information

Substance Summary

Cite this page

Crystallographic Data

Cell Parameters

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Atom Coordinates

Standardized

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Published

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Displacement Parameters

Isotropic

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Anisotropic

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Experimental Details

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Reference

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3D Interactive Structure

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About this content

Cite this content

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Zn₁₃Tl₆₆Si₁₀₀Al₉₂O₃₈₄·2ZnO (Tl_16.5Zn_3.75Al₂₃Si₂₅O_96.5) Crystal Structure