Structure 1000091

1000090 << 1000091 >> 1000092
Original COD entry Download CIF Download DOT

Citation: Laval, J P; Abaouz, A; Frit, B; Le Bail, A (1990). Short-range order in the anion-excess fluorite-related Ca~0.68~Ln~0.32~F~2.32~ solid solutions: EXAFS study of the Ln^3+^ environment. Journal of Solid State Chemistry, 85, pp. 133-143.

Formula: Ca2.028 F7 Lu0.972

Chemical name: Calcium lutetium fluoride (2.03/.97/7)

Cell parameters:

  • a = 8.6633(3) Å
  • b = 8.6633(3) Å
  • c = 16.5252(8) 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: Ca30 F68 Lu30 (Ca15 F34 Lu15)

Multiplicity: 1

Coordination sequences:

  • 1, 10, 29, 101, 164, 291, 433, 620, 854, 1124
  • 1, 12, 36, 68, 194, 258, 393, 590, 817, 1086
  • 1, 12, 40, 88, 190, 270, 488, 686, 850, 1084
  • 1, 12, 40, 98, 182, 327, 492, 690, 873, 1165
  • 2, 24, 68, 130, 235, 420, 578, 792, 999, 1311
  • 3, 28, 59, 132, 250, 397, 546, 748, 1015, 1308
  • 4, 33, 69, 160, 259, 420, 604, 792, 1052, 1354
  • 4, 34, 76, 166, 254, 393, 599, 840, 1061, 1345
  • 4, 34, 84, 200, 284, 418, 638, 890, 1132, 1410
  • 4, 38, 78, 160, 274, 433, 612, 813, 1036, 1422
  • 11, 29, 101, 164, 291, 433, 620, 854, 1124, 1391
  • 13, 36, 68, 194, 258, 393, 590, 817, 1086, 1350
  • 13, 40, 88, 190, 270, 488, 686, 850, 1084, 1434
  • 13, 40, 98, 182, 327, 492, 690, 873, 1165, 1517
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