Inorganic Solid Phases

Na_6.3Pd_0.5D_49.2-Y zeolite (D_12.4Na_1.6Al₁₄Si₃₄O₉₆, T = 5 K) Crystal Structure

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General Information

Phase Label(s): D_12.4Na_1.6Al₁₄Si₃₄O₉₆
Structure Class(es): zeolite FAU
Classification by Properties: –
Mineral Name(s): –
Pearson Symbol: cF592
Space Group: 227
Phase Prototype: H_13.25Na_0.75(Al_0.29Si_0.71)₄₈O₉₆
Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; France, Grenoble, Institut Laue-Langevin ILL, D2B (determination of structural parameters), neutrons; λ = 0.1594 nm (determination of cell and structural parameters), T = 5 K (determination of cell and structural parameters)
Phase Class(es): –
Compound Class(es): silicate
Interpretation Detail(s): positions of non-H and part of H atoms determined, Rietveld refinement; 53 variables; 582 reflections, wR_P = 0.118; R_B = 0.09
Sample Detail(s): sample prepared from Na₅₆Al₅₆Si₁₃₆O₃₈₄, atomic absorption spectroscopy; Na_6.3Pd_0.5D_49.2Al₅₆Si₁₃₆O₃₈₄, powder (determination of cell and structural parameters)

Substance Summary

Standard Formula: D_12.4Na_1.6Al₁₄Si₃₄O₉₆
Alphabetic Formula: Al₁₄D_12.4Na_1.6O₉₆Si₃₄
Published Formula: Na_6.3Pd_0.5D_49.2-Y zeolite
Refined Formula: Al_14.02D_11.06Na_1.57O₉₆Si_33.98
Wyckoff Sequence: 227,ihg³c
Z Formula Units: 4
Density: ρ = 1.29 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 B [nm²]	Type	Computed B_eq [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_1001720

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 Na6.3Pd0.5D49.2-Y zeolite (D12.4Na1.6Al14Si34O96, T = 5 K) Crystal Structure sd_1001720 (Springer-Verlag GmbH, Heidelberg, © 2016)

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