Inorganic Solid Phases

γ-Ag₃SBr_0.6I_0.4 (Ag₃SI_0.5Br_0.5 lt, T = 16 K) Crystal Structure

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General Information

Phase Label(s): Ag₃SI_0.5Br_0.5 lt
Structure Class(es): –
Classification by Properties: –
Mineral Name(s): –
Pearson Symbol: oP40
Space Group: 31
Phase Prototype: Ag₃S(I_0.4Br_0.6)
Measurement Detail(s): automatic diffractometer (determination of cell and structural parameters), X-rays, Cu Kα (determination of cell and structural parameters), T = 16 K (determination of cell and structural parameters)
Phase Class(es): –
Compound Class(es): bromide, iodide, sulfide
Interpretation Detail(s): complete structure determined, Rietveld refinement, wR_P = 0.1066; R_B = 0.0273
Sample Detail(s): sample prepared from Ag₂S, AgI, AgBr, powder (determination of cell and structural parameters)

Substance Summary

Standard Formula: Ag₃SI_0.4Br_0.6
Alphabetic Formula: Ag₃Br_0.6I_0.4S
Published Formula: γ-Ag₃SBr_0.6I_0.4
Refined Formula: Ag₃Br_0.60I_0.40S
Wyckoff Sequence: 31,b⁶a⁸
Z Formula Units: 8
Density: ρ = 6.90 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_1627845

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 γ-Ag3SBr0.6I0.4 (Ag3SI0.5Br0.5 lt, T = 16 K) Crystal Structure sd_1627845 (Springer-Verlag GmbH, Heidelberg, © 2016)

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