Structure 2008058

2008042 << 2008058 >> 2008089
Original COD entry Download CIF Download DOT

Citation: Currao, Antonio (1999). Ba~4~Ti~12~O~27~: Rietveld refinement using x-ray powder diffraction data. Acta Crystallographica Section C, 55, pp. 02-04.

Formula: Ba4 O27 Ti12

Cell parameters:

  • a = 19.8165(2) Å
  • b = 11.44680(10) Å
  • c = 9.92080(10) Å
  • α = 90°
  • β = 109.1847(5)°
  • 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: O108 Ti48 (O9 Ti4)

Multiplicity: 1

Coordination sequences:

  • 2, 10, 15, 64, 101, 152, 158, 260, 301, 486
  • 2, 12, 16, 37, 65, 120, 180, 259, 315, 414
  • 2, 12, 18, 60, 95, 150, 177, 271, 309, 485
  • 2, 13, 28, 58, 86, 145, 169, 297, 346, 479
  • 2, 15, 28, 57, 86, 144, 200, 288, 367, 471
  • 2, 15, 28, 59, 97, 151, 192, 297, 370, 495
  • 3, 15, 22, 69, 88, 122, 184, 280, 363, 478
  • 3, 16, 21, 47, 74, 133, 214, 277, 356, 416
  • 3, 17, 23, 55, 72, 140, 221, 291, 337, 469
  • 3, 17, 27, 62, 99, 132, 199, 288, 378, 483
  • 3, 17, 27, 65, 103, 135, 205, 286, 363, 509
  • 3, 18, 26, 48, 76, 117, 220, 290, 325, 448
  • 3, 21, 32, 65, 109, 151, 207, 320, 384, 500
  • 3, 23, 39, 59, 106, 153, 218, 323, 406, 492
  • 3, 25, 38, 42, 112, 137, 232, 317, 425, 454
  • 4, 21, 27, 54, 90, 135, 248, 307, 349, 477
  • 6, 6, 38, 68, 124, 150, 206, 224, 414, 468
  • 6, 11, 40, 70, 116, 128, 227, 278, 412, 475
  • 8, 14, 35, 53, 105, 160, 234, 291, 401, 448
  • 9, 18, 44, 76, 113, 147, 236, 320, 425, 523
  • 9, 19, 38, 53, 99, 152, 253, 287, 402, 487
  • 10, 18, 28, 64, 101, 167, 249, 304, 397, 477
  • 10, 22, 44, 84, 116, 166, 250, 324, 452, 524
  • 11, 22, 43, 88, 105, 180, 237, 350, 421, 556
  • 11, 23, 37, 64, 99, 184, 250, 336, 386, 502
  • 12, 24, 32, 68, 90, 158, 280, 288, 370, 512
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