Structure 1001791

1001790 << 1001791 >> 1001792
Original COD entry Download CIF Download DOT

Citation: Sundaresan, A; Michel, C; Raveau, B; Huong, P V (1997). Charge-transfer-induced insulator-superconductor transition in Tl Ba2-x Srx Ca0.4 Pr0.6 Cu2 O7-d : a joint neutron/X ray Rietveld refinement, infrared absorption, and Raman scattering studies. Chemistry of Materials (1,1989-, 9, pp. 2212-2217.

Formula: Ba Ca0.432 Cu2 O6.98 Pr0.568 Sr Tl0.964

Chemical name: Thallium barium strontium calcium praseodymium copper oxide(0.96/1/1/0.43/0.57/2/6.98)

Cell parameters:

  • a = 3.85262(4) Å
  • b = 3.85262(4) Å
  • c = 12.2813(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: Ca Cu2 O10 Pr Tl4 (Ca Cu2 O10 Pr Tl4)

Multiplicity: 1

Coordination sequences:

  • 1, 20, 60, 132, 260, 380, 550, 782, 996, 1300
  • 4, 35, 84, 178, 310, 449, 654, 883, 1136, 1452
  • 5, 22, 78, 141, 274, 429, 650, 914, 1185, 1498
  • 7, 19, 32, 74, 178, 292, 480, 692, 914, 1234
  • 10, 20, 50, 136, 240, 404, 608, 814, 1114, 1435
  • 10, 53, 117, 222, 374, 550, 757, 1005, 1286, 1594
  • 21, 60, 132, 260, 380, 550, 782, 996, 1300, 1604
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