Structure 4118392

4118378 << 4118392 >> 4118395
Original COD entry Download CIF Download DOT

Citation: Yuri Janssen; Derek S. Middlemiss; Shou-Hang Bo; Clare P. Grey; Peter G. Khalifah (2012). Structural Modulation in the High Capacity Battery Cathode Material LiFeBO3. Journal of the American Chemical Society, 134, pp. 12516-12527.

Formula: B4 Fe4 Li4 O12

Chemical name: ?

Cell parameters:

  • a = 10.3362(6) Å
  • b = 8.8687(8) Å
  • c = 10.1656(9) Å
  • α = 90°
  • β = 91.514(8)°
  • 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: B16 Fe16 O48 (B Fe O3)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 11, 24, 39, 54, 77, 101, 125, 158
  • 2, 6, 11, 24, 39, 55, 77, 98, 126, 165
  • 3, 4, 15, 27, 40, 58, 76, 103, 137, 157
  • 3, 9, 15, 26, 42, 59, 82, 106, 129, 168
  • 5, 9, 16, 25, 43, 63, 80, 102, 136, 166
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