Inorganic Solid Phases

TlNO3 (III) (Tl[NO3] rt, T = 300 K) Crystal Structure

General Information

  • Phase Label(s): Tl[NO3] rt
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: oP40
  • Space Group: 62
  • Phase Prototype: Tl[NO3]-b
  • Measurement Detail(s): automatic diffractometer; 50 (determination of cell parameters), automatic diffractometer; India, Trombay-Mumbai, Bhabha Atomic Research Centre BARC, CIRUS reactor (determination of structural parameters), neutrons; λ = 0.1216 nm (determination of cell and structural parameters), T = 300 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): nitrate
  • Interpretation Detail(s): complete structure determined, least-squares refinement on F2; 61 variables; 191 reflections; F2 > 1σ(F2), R = 0.0165; wR = 0.039
  • Sample Detail(s): sample prepared from TlNO3, single crystal (determination of cell parameters), single crystal, 2.3×3.8×5.4 mm3 (determination of structural parameters)

Substance Summary

  • Standard Formula: Tl[NO3]
  • Alphabetic Formula: [NO3]Tl
  • Published Formula: TlNO3 (III)
  • Refined Formula: NO3Tl
  • Wyckoff Sequence: 62,d2c6
  • Z Formula Units: 8
  • Density: ρ = 5.67 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_1501774

  • 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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