Structure 2300544

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Original COD entry Download CIF Download DOT

Citation: Winterer, M.; Delaplane, R.; McGreevy, R. (2002). X-ray diffraction, neutron scattering and EXAFS spectroscopy of monoclinic zirconia: analysis by Rietveld refinement and reverse Monte Carlo simulations. Journal of Applied Crystallography, 35, pp. 434-442.

Formula: O2 Zr

Chemical name: Zr O2

Cell parameters:

  • a = 5.1487 Å
  • b = 5.2023 Å
  • c = 5.3231 Å
  • α = 90°
  • β = 99.164°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 1

Basis: (1;0;0 0;1;0 0;0;1)

Dimensionality: 3

Formula: O8 Zr4 (O2 Zr)

Multiplicity: 1

Coordination sequences:

  • 3, 27, 73, 146, 253, 367, 515, 700, 881, 1109
  • 4, 31, 80, 162, 263, 385, 544, 715, 916, 1142
  • 12, 41, 102, 184, 287, 422, 579, 754, 965, 1195
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