Structure 1565386

1565354 << 1565386 >> 1565395
Original COD entry Download CIF Download DOT

Citation: Zheng, Xu; Yan, Dayu; Yi, Changjiang; Zhu, Jinlong; Zhang, Qinghua; Zhai, Junyi; Ma, Teng; Zhu, Pinwen; Li, Hui; Gu, Lin; Zhao, Yusheng; Yao, Yugui; Shi, Youguo; Yu, Xiaohui; Jin, Changqing (2022). The discovery of a superhard P-type transparent semiconductor: Al2.69B50.. Materials horizons, 9, pp. 748-755.

Formula: Al2.69 B50

Cell parameters:

  • a = 12.661(3) Å
  • b = 12.337(2) Å
  • c = 5.0928(11) 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: Al12 B100 (Al3 B25)

Multiplicity: 1

Coordination sequences:

  • 6, 20, 50, 102, 161, 240, 334, 438, 593, 718
  • 6, 20, 52, 96, 151, 238, 330, 433, 578, 708
  • 6, 28, 50, 82, 178, 242, 302, 440, 554, 708
  • 7, 21, 52, 99, 164, 242, 315, 440, 585, 711
  • 7, 21, 56, 103, 166, 244, 326, 443, 587, 717
  • 7, 23, 59, 101, 157, 243, 346, 459, 570, 719
  • 7, 25, 63, 108, 163, 253, 347, 467, 587, 724
  • 8, 22, 49, 100, 164, 237, 330, 443, 576, 722
  • 8, 23, 53, 106, 174, 245, 334, 448, 585, 734
  • 8, 32, 62, 104, 172, 246, 384, 480, 578, 740
  • 11, 28, 53, 116, 184, 254, 346, 462, 604, 738
  • 11, 28, 53, 120, 184, 250, 344, 456, 612, 736
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