Inorganic Solid Phases

(KCN)0.9(KBr)0.1, o (KBr0.1[CN]0.9 lt2, T = 9 K) Crystal Structure

General Information

  • Phase Label(s): KBr0.1[CN]0.9 lt2
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: oI6
  • Space Group: 71
  • Phase Prototype: K[CN]
  • Measurement Detail(s): diffractometer (determination of cell parameters), automatic diffractometer; U.S.A. Maryland, Gaithersburg, NIST Center for Neutron Research, NBSR (determination of structural parameters), neutrons (determination of cell and structural parameters), T = 9 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): cyanide, bromide
  • Interpretation Detail(s): complete structure determined; temperature dependence studied, Rietveld refinement
  • Sample Detail(s): sample prepared from KCN, KBr, amounts of monoclinic phase (90-95 wt.%), powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: KBr0.1[CN]0.9
  • Alphabetic Formula: Br0.1[CN]0.9K
  • Published Formula: (KCN)0.9(KBr)0.1, o
  • Refined Formula: Br0.1C0.9KN0.9
  • Wyckoff Sequence: 71,ca
  • Z Formula Units: 2
  • Density: ρ = 1.74 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

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_0380478

  • 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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