Structure 4002985

4002984 << 4002985 >> 4002994
Original COD entry Download CIF Download DOT

Citation: He, Allan; Bux, Sabah K.; Hu, Yufei; Uhl, David; Li, Li; Donadio, Davide; Kauzlarich, Susan M. (2019). Structural Complexity and High Thermoelectric Performance of the Zintl Phase: Yb21Mn4Sb18. Chemistry of Materials, 31, pp. 8076-.

Formula: Mn4 Sb18 Yb21

Cell parameters:

  • a = 16.930(3) Å
  • b = 17.029(3) Å
  • c = 16.693(3) Å
  • α = 90°
  • β = 92.61(3)°
  • 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: Mn20 Sb88 Yb88 (Mn5 Sb22 Yb22)

Multiplicity: 1

Coordination sequences:

  • 5, 29, 82, 191, 304, 459, 644, 868, 1144, 1463
  • 6, 23, 94, 192, 310, 486, 693, 891, 1198, 1496
  • 7, 46, 110, 210, 338, 515, 690, 945, 1226, 1530
  • 7, 47, 113, 209, 346, 519, 707, 953, 1242, 1528
  • 7, 49, 118, 220, 336, 524, 726, 946, 1252, 1541
  • 7, 49, 119, 220, 341, 519, 726, 945, 1254, 1520
  • 8, 48, 115, 214, 353, 517, 743, 962, 1231, 1566
  • 8, 49, 116, 221, 348, 520, 728, 964, 1224, 1553
  • 8, 50, 117, 216, 338, 520, 720, 965, 1242, 1560
  • 9, 42, 111, 197, 331, 506, 692, 946, 1210, 1523
  • 9, 47, 114, 210, 355, 507, 701, 973, 1207, 1537
  • 9, 50, 117, 216, 354, 521, 723, 965, 1229, 1544
  • 9, 51, 108, 209, 342, 492, 707, 954, 1212, 1531
  • 9, 53, 118, 216, 351, 521, 721, 961, 1234, 1531
  • 10, 40, 102, 197, 333, 487, 675, 911, 1183, 1509
  • 10, 45, 111, 212, 337, 505, 716, 935, 1219, 1538
  • 11, 47, 132, 233, 367, 538, 752, 976, 1222, 1567
  • 11, 51, 117, 215, 354, 521, 725, 965, 1255, 1556
  • 12, 57, 124, 232, 363, 537, 755, 985, 1263, 1574
  • 13, 48, 116, 216, 350, 516, 712, 974, 1230, 1536
  • 13, 50, 132, 226, 372, 547, 746, 981, 1286, 1566
  • 15, 53, 127, 222, 373, 525, 746, 979, 1274, 1587
  • 15, 54, 130, 228, 369, 536, 756, 984, 1273, 1573
  • 15, 59, 131, 237, 370, 560, 756, 1002, 1272, 1589
  • 16, 49, 128, 225, 365, 538, 735, 976, 1285, 1571
  • 16, 57, 130, 236, 374, 552, 769, 1002, 1278, 1588
  • 18, 56, 116, 221, 364, 523, 734, 988, 1251, 1552
  • 18, 57, 127, 231, 366, 540, 746, 1004, 1263, 1568
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