Structure 4003864

4003863 << 4003864 >> 4003865
Original COD entry Download CIF Download DOT

Citation: Calder\'on-Cueva, Mario; Peng, Wanyue; Clarke, Samantha M.; Ding, Jingxuan; Brugman, Benjamin L.; Levental, Gill; Balodhi, Ashiwini; Rylko, Megan; Delaire, Olivier; Walsh, James P. S.; Dorfman, Susannah M.; Zevalkink, Alexandra (2021). Anisotropic Structural Collapse of Mg3Sb2 and Mg3Bi2 at High Pressure. Chemistry of Materials, 33, pp. 567-573.

Formula: Mg3 Sb2

Cell parameters:

  • a = 15.118(7) Å
  • b = 4.2228(7) Å
  • c = 7.7014(12) Å
  • α = 90°
  • β = 117.56(2)°
  • 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: Mg12 Sb8 (Mg3 Sb2)

Multiplicity: 1

Coordination sequences:

  • 1, 4, 9, 23, 28, 54, 58, 116, 106, 183
  • 2, 8, 16, 36, 40, 72, 76, 152, 136, 218
  • 3, 7, 15, 18, 48, 54, 98, 90, 174, 153
  • 4, 8, 12, 30, 34, 72, 78, 134, 114, 227
  • 4, 14, 18, 34, 40, 80, 80, 156, 138, 214
  • 5, 9, 23, 28, 54, 58, 116, 106, 183, 163
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