Inorganic Solid Phases

Li3Sc2[PO4]3, α (Li3Sc2[PO4]3 ht1) Crystal Structure

General Information

  • Phase Label(s): Li3Sc2[PO4]3 ht1
  • Structure Class(es):
  • Classification by Properties: ionic conductor, superionic conductor
  • Mineral Name(s):
  • Pearson Symbol: mP80
  • Space Group: 14
  • Phase Prototype: Li3Sc2[PO4]3
  • Measurement Detail(s): diffractometer (determination of cell parameters), diffractometer; Russia, Obninsk, Karpov Institute of Physical Chemistry, VVR-Ts reactor (determination of structural parameters), neutrons; λ = 0.1167 nm (determination of cell and structural parameters), T = 293 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): orthophosphate
  • Interpretation Detail(s): complete structure determined, least-squares refinement; 2460 reflections; I > 3σ(I), R = 0.037; wR = 0.044
  • Sample Detail(s): single crystal (determination of cell parameters), single crystal, 3×3×5 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Li3Sc2[PO4]3
  • Alphabetic Formula: Li3[PO4]3Sc2
  • Published Formula: Li3Sc2[PO4]3, α
  • Refined Formula: Li3O12P3Sc2
  • Wyckoff Sequence: 14,e20
  • Z Formula Units: 4
  • Density: ρ = 2.75 Mg·m−3

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

Displacement Parameters

Isotropic

Site
Published
B [nm2]
Type
Computed
Beq [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1610633

  • 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

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