Inorganic Solid Phases

Pb[Fe₃(SO₄)₂(OH)₆]₂ (Fe₃Pb_0.5[SO₄]₂[OH]₆) Crystal Structure

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General Information

Phase Label(s): Fe₃Pb_0.5[SO₄]₂[OH]₆
Structure Class(es): –
Classification by Properties: –
Mineral Name(s): plumbojarosite
Pearson Symbol: hR60
Space Group: 166
Phase Prototype: KAl₃[SO₄]₂[OH]₆
Measurement Detail(s): 72 (determination of cell parameters), X-rays, Mo Kα; λ = 0.070930 nm (determination of structural parameters)
Phase Class(es): –
Compound Class(es): hydroxide, sulfate
Interpretation Detail(s): complete structure determined, full-matrix least-squares refinement; 1199 reflections; I > 1.65σ(I), R = 0.0160
Sample Detail(s): sample from U.S.A. Utah, Dividend, Tintic Standard mine, electron microprobe analysis; composition confirmed, single crystal (determination of structural parameters)

Substance Summary

Standard Formula: Fe₃Pb_0.5[SO₄]₂[OH]₆
Alphabetic Formula: Fe₃[OH]₆Pb_0.5[SO₄]₂
Published Formula: Pb[Fe₃(SO₄)₂(OH)₆]₂
Refined Formula: Fe₃H₆O₁₄Pb_0.50S₂
Wyckoff Sequence: 166,h⁵c⁴ba
Z Formula Units: 6
Density: ρ = 3.62 Mg·m⁻³

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Crystallographic Data

Cell Parameters

	Published Data	Standardized Data
	Published Data	Unit Cell	Niggli-Reduced Cell
Space Group	Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial
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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Anisotropic

Site	U₁₁ [nm²]	U₂₂ [nm²]	U₃₃ [nm²]	U₁₂ [nm²]	U₁₃ [nm²]	U₂₃ [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_2041478

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 Pb[Fe3(SO4)2(OH)6]2 (Fe3Pb0.5[SO4]2[OH]6) Crystal Structure sd_2041478 (Springer-Verlag GmbH, Heidelberg, © 2016)

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