Inorganic Solid Phases

α-Ag₃SI (Ag_1.5S_0.5I_0.5 ht, T = 715 K) Crystal Structure

Get Access CIF Download help (pdf)

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

General Information

Phase Label(s): Ag_1.5S_0.5I_0.5 ht
Structure Class(es): –
Classification by Properties: –
Mineral Name(s): –
Pearson Symbol: cI34
Space Group: 229
Phase Prototype: Ag_1.5(S_0.5I_0.5)
Measurement Detail(s): automatic diffractometer; 20 (determination of cell parameters), automatic diffractometer; U.S.A. New York, Brookhaven National Laboratory, HFBR, H6M (determination of structural parameters), neutrons; λ = 0.105099(6) nm (determination of cell and structural parameters), T = 715 K (determination of cell and structural parameters)
Phase Class(es): –
Compound Class(es): iodide, sulfide
Interpretation Detail(s): complete structure determined; temperature dependence studied, full-matrix least-squares refinement on F²; 19 reflections; F² > 1σ(F²), R = 0.020; wR = 0.033
Sample Detail(s): single crystal (determination of cell parameters), single crystal, 2.1×2.1×6.8 mm³ (determination of structural parameters)

Substance Summary

Standard Formula: Ag_1.5S_0.5I_0.5
Alphabetic Formula: Ag_1.5I_0.5S_0.5
Published Formula: α-Ag₃SI
Refined Formula: Ag_1.48I_0.50S_0.50
Wyckoff Sequence: 229,gca
Z Formula Units: 2
Density: ρ = 6.54 Mg·m⁻³

View 3D Interactive Structure

Cite this page

Citation

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.
Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial

Published

Site	Element	Wyckoff Symbol	Symmetry	X	Y	Z	Occupation
Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial

Displacement Parameters

Anisotropic

Site	β₁₁ [nm²]	β₂₂ [nm²]	β₃₃ [nm²]	β₁₂ [nm²]	β₁₃ [nm²]	β₂₃ [nm²]
Content available to subscribers To view content, please Log in, contact your Springer representative, or get a free trial

Experimental Details

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

Reference

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

3D Interactive Structure

Content available to subscribers
To view content, please Log in, contact your Springer representative, or get a free trial

About this content

Database name

PAULING FILE Multinaries Edition – 2012

Dataset ID

sd_1301941

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 α-Ag3SI (Ag1.5S0.5I0.5 ht, T = 715 K) Crystal Structure sd_1301941 (Springer-Verlag GmbH, Heidelberg, © 2016)

Download this citation

Citation copied