Structure 9004138

9004137 << 9004138 >> 9004139
Original COD entry Download CIF Download DOT

Citation: Meagher, E. P.; Lager, G. A. (1979). Polyhedral thermal expansion in the TiO2 polymorphs: Refinement of the crystal structures of rutile and brookite at high temperature Sample at 280 degrees C. The Canadian Mineralogist, 17, pp. 77-85.

Formula: O2 Ti

Cell parameters:

  • a = 9.175 Å
  • b = 5.459 Å
  • c = 5.149 Å
  • α = 90°
  • β = 90°
  • 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: O16 Ti8 (O2 Ti)

Multiplicity: 1

Coordination sequences:

  • 3, 18, 38, 92, 147, 198, 303, 386, 480, 637
  • 3, 21, 44, 89, 149, 221, 291, 401, 509, 607
  • 9, 22, 60, 103, 160, 230, 323, 408, 531, 661
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