Structure 4002741

4002740 << 4002741 >> 4002742
Original COD entry Download CIF Download DOT

Citation: Nam, Gnu; Choi, Woongjin; Jo, Hongil; Ok, Kang Min; Ahn, Kyunghan; You, Tae-Soo (2017). Influence of Thermally Activated Solid-State Crystal-to-Crystal Structural Transformation on the Thermoelectric Properties of the Ca5--xYbxAl2Sb6 (1.0 ≤ x ≤ 5.0) System. Chemistry of Materials, 29, pp. 1384-.

Formula: Al2 Ca3.6 Sb6 Yb1.4

Chemical name: ?

Cell parameters:

  • a = 11.962(6) Å
  • b = 13.929(8) Å
  • c = 4.427(2) 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: Al4 Ca10 Sb12 Yb10 (Al2 Ca5 Sb6 Yb5)

Multiplicity: 1

Coordination sequences:

  • 1, 8, 32, 97, 170, 295, 425, 643, 773, 1089
  • 1, 10, 42, 102, 176, 310, 420, 646, 802, 1096
  • 1, 12, 37, 96, 179, 315, 433, 638, 806, 1097
  • 6, 27, 80, 157, 273, 416, 569, 796, 976, 1318
  • 6, 31, 78, 166, 261, 424, 583, 789, 1038, 1264
  • 7, 38, 90, 182, 275, 453, 587, 848, 997, 1333
  • 8, 38, 78, 190, 283, 449, 603, 837, 1002, 1381
  • 9, 32, 97, 170, 295, 425, 643, 773, 1089, 1262
  • 11, 42, 102, 176, 310, 420, 646, 802, 1096, 1250
  • 13, 37, 96, 179, 315, 433, 638, 806, 1097, 1269
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