Inorganic Solid Phases

LixIn1.82Sn0.45S4, x= 1.73, sample 5.0 Li/mol (Li0.625In0.91Sn0.225S2) Crystal Structure

Get Access CIF Download help (pdf)

General Information

  • Phase Label(s): Li0.625In0.91Sn0.225S2
  • Structure Class(es): rocksalt family
  • Classification by Properties: –
  • Mineral Name(s): –
  • Pearson Symbol: cF64
  • Space Group: 227
  • Phase Prototype: LiTiO2
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; Philips (determination of structural parameters), X-rays, Cu Kα; λ = 0.15418 nm (determination of cell and structural parameters)
  • Phase Class(es): –
  • Compound Class(es): sulfide
  • Interpretation Detail(s): complete structure determined, Rietveld refinement, multiphase, RP = 0.0388; wRP = 0.0485; RB = 0.0211
  • Sample Detail(s): sample prepared from Cu0.73In1.81Sn0.46S4, (n-C4H9)Li, atomic emission spectroscopy; Li content analyzed; amounts of Cu0.73In1.81Sn0.46S4 spinel phase (1.7 wt.%), powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Li0.865In0.91Sn0.225S2
  • Alphabetic Formula: In0.91Li0.865S2Sn0.225
  • Published Formula: LixIn1.82Sn0.45S4, x= 1.73, sample 5.0 Li/mol
  • Refined Formula: In0.91Li0.86S2Sn0.22
  • Wyckoff Sequence: 227,edc
  • Z Formula Units: 16
  • Density: ρ = 4.30 Mg·m−3
View 3D Interactive Structure

Cite this page

Crystallographic Data

Cell Parameters

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

Published

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1719884

  • 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.

    Data generated pre-2002: © Springer & MPDS & NIMS; post-2001: © Springer & MPDS

    All Rights Reserved. Version 2016.10.

    Project Coordinator: Shuichi Iwata

    Section-Editor: Karin Cenzual (Crystal Structures)

    • Cite this content

    Download this citation

    Citation copied