Structure 1532733

1532732 << 1532733 >> 1532734
Original COD entry Download CIF Download DOT

Citation: Brinks, H.W.; Maeland, A.J.; Hauback, B.C.; Bowman, R.C.jr.; Cantrell, J.S. (2003). Determination of deuterium site occupation in Zr4 Pd2 O D4.5. Journal of Alloys Compd., 361, pp. 108-112.

Formula: D4.455 O Pd2 Zr4

Chemical name: Zr4 Pd2 O D4.455

Cell parameters:

  • a = 12.806 Å
  • b = 12.806 Å
  • c = 12.806 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: D192 O16 Pd32 Zr64 (D12 O Pd2 Zr4)

Multiplicity: 1

Coordination sequences:

  • 4, 51, 179, 411, 728, 1176, 1696, 2325, 3124, 3896
  • 6, 78, 224, 486, 848, 1232, 1866, 2544, 3272, 4248
  • 18, 97, 268, 529, 883, 1426, 1903, 2606, 3468, 4168
  • 24, 86, 276, 576, 914, 1434, 2042, 2648, 3420, 4400
  • 24, 119, 295, 568, 970, 1429, 2070, 2769, 3516, 4527
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