Structure 2108454

2108453 << 2108454 >> 2108455
Original COD entry Download CIF Download DOT

Citation: Fukui, Hiroshi; Fujimoto, Manato; Akahama, Yuichi; Sano-Furukawa, Asami; Hattori, Takanori (2019). Structure change of monoclinic ZrO~2~ baddeleyite involving softenings of bulk modulus and atom vibrations. Acta Crystallographica Section B, 75, pp. -.

Formula: O2 Zr

Cell parameters:

  • a = 5.09098(29) Å
  • b = 5.20930(33) Å
  • c = 5.23197(32) Å
  • α = 90.0°
  • β = 98.706(5)°
  • γ = 90.0°

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, 29, 83, 164, 283, 421, 591, 794, 1017, 1277
  • 4, 32, 86, 174, 287, 429, 603, 802, 1032, 1290
  • 13, 47, 115, 209, 331, 484, 666, 873, 1114, 1381
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