Structure 9011330

9011329 << 9011330 >> 9011331
Original COD entry Download CIF Download DOT

Citation: Michiue, Y. (2007). Probability density analyses of guest ions in hollandite AxMgx/2Ti8-x/2O16 (A = K, Rb) Sample: 4. Acta Crystallographica, Section B, 63, pp. 577-583.

Formula: K0.77 Mg0.385 O8 Ti3.615

Cell parameters:

  • a = 10.1541 Å
  • b = 10.1541 Å
  • c = 2.9735 Å
  • α = 90°
  • β = 90°
  • γ = 90°

List type: interleaving

List: 1-3D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 3

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

Dimensionality: 3

Formula: Mg8 O16 Ti8 (Mg O2 Ti)

Multiplicity: 1

Coordination sequences:

  • 6, 16, 40, 86, 128, 197, 297, 362, 510, 590
  • 6, 23, 53, 96, 165, 227, 334, 422, 517, 700
  • 7, 16, 42, 82, 140, 227, 287, 410, 498, 635
  • 11, 29, 61, 107, 161, 253, 322, 433, 551, 658
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CIF datablock 1, entity 2 of 3

Basis: (0;0;1)

Dimensionality: 1

Formula: K3 (K)

Multiplicity: 1

Coordination sequences:

  • 6, 6, 6, 6, 6, 6, 6, 6, 6, 6
span 1 {1 1 1}

CIF datablock 2, entity 3 of 3

Basis: (0;0;1)

Dimensionality: 1

Formula: K3 (K)

Multiplicity: 1

Coordination sequences:

  • 6, 6, 6, 6, 6, 6, 6, 6, 6, 6
span 1 {1 1 1}