Structure 4323086

4323083 << 4323086 >> 4323098
Original COD entry Download CIF Download DOT

Citation: Robert Lam; Arthur Mar (1998). Ternary Arsenide Ba0.8Hf12As17.7, a Variant of the Cr12P7 Structure Type with Inserted Arsenic Ribbons. Inorganic Chemistry, 37, pp. 5364-5368.

Formula: As17.7 Ba0.8 Hf12

Chemical name: ?

Cell parameters:

  • a = 14.9969(11) Å
  • b = 14.9969(11) Å
  • c = 3.5526(4) Å
  • α = 90.00°
  • β = 90.00°
  • γ = 120.00°

List type: interleaving

List: 1-3D

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span 1 {1 1 1}
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Molecules

CIF datablock 0, entity 1 of 2

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

Dimensionality: 3

Formula: As24 Hf12 (As2 Hf)

Multiplicity: 1

Coordination sequences:

  • 5, 24, 46, 92, 150, 222, 279, 376, 517, 610
  • 6, 30, 49, 102, 127, 226, 308, 429, 542, 635
  • 8, 26, 65, 90, 154, 218, 331, 433, 536, 677
  • 8, 27, 52, 106, 157, 228, 316, 404, 555, 631
  • 8, 29, 55, 102, 157, 229, 317, 423, 551, 664
  • 9, 24, 55, 94, 167, 219, 303, 419, 515, 671
span 1 {1 1 1}

CIF datablock 1, entity 2 of 2

Basis: (0;0;1)

Dimensionality: 1

Formula: Ba4 (Ba)

Multiplicity: 1

Coordination sequences:

  • 6, 6, 6, 6, 6, 6, 6, 6, 6, 6
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