Structure 1531678

1531677 << 1531678 >> 1531679
Original COD entry Download CIF Download DOT

Citation: Kini, N.S.; Shivashankar, S.A.; Umarji, A.M.; Yelon, W.B.; Malik, S.K. (2002). Effect of synthesis route on the structure of Nd3-x Ba3+x Cu6 O14-2d (x=0, 1) system: a neutron diffraction study. Solid State Communications, 122, pp. 99-104.

Formula: Ba1.7 Cu3 Nd1.3 O6.8

Chemical name: Nd (Nd0.3 Ba1.7) Cu3 O6.8

Cell parameters:

  • a = 3.8757 Å
  • b = 3.9139 Å
  • c = 11.7455 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: Ba2 Cu3 Nd3 O8 (Ba2 Cu3 Nd3 O8)

Multiplicity: 1

Coordination sequences:

  • 1, 17, 90, 215, 430, 655, 1006, 1347, 1874, 2283
  • 2, 22, 98, 302, 474, 748, 1070, 1598, 1934, 2492
  • 4, 41, 122, 292, 500, 884, 1126, 1556, 1980, 2740
  • 6, 53, 170, 347, 567, 858, 1258, 1683, 2131, 2666
  • 13, 78, 203, 390, 686, 999, 1335, 1766, 2354, 2919
  • 14, 74, 242, 408, 658, 966, 1450, 1792, 2322, 2838
  • 18, 90, 215, 430, 655, 1006, 1347, 1874, 2283, 2946
  • 22, 82, 214, 404, 718, 978, 1366, 1772, 2438, 2850
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