Structure 9013714

9013713 << 9013714 >> 9013715
Original COD entry Download CIF Download DOT

Citation: Alvaro, M.; Nestola, F.; Ballaran, T. B.; Camara, F.; Domeneghetti, M. C.; Tazzoli, V. (2010). High-pressure phase transition of a natural pigeonite Note: P = 6.409 GPa. American Mineralogist, 95, pp. 300-311.

Formula: Al0.02 Ca0.121 Fe1.008 Mg0.871 O6 Si1.98

Cell parameters:

  • a = 9.434 Å
  • b = 8.745 Å
  • c = 5.014 Å
  • α = 90°
  • β = 103.44°
  • γ = 90°

List type: noninterleaving

List: 3D

Combined 3D structure and graph

span 1 {1 1 1}
Ctrl-click to select multiple nodes

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: Al8 Ca4 Fe8 Mg8 O24 Si8 (Al2 Ca Fe2 Mg2 O6 Si2)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 24, 56, 96, 144, 224, 305, 408, 519
  • 4, 8, 26, 62, 118, 182, 258, 341, 439, 567
  • 4, 10, 28, 74, 108, 184, 261, 352, 452, 589
  • 5, 13, 35, 83, 140, 213, 289, 384, 497, 624
  • 6, 17, 51, 93, 151, 222, 310, 401, 528, 624
  • 7, 19, 47, 96, 158, 228, 307, 403, 512, 653
  • 7, 21, 42, 86, 140, 226, 307, 418, 501, 648
  • 7, 22, 49, 89, 151, 217, 310, 404, 514, 638
  • 8, 24, 56, 96, 144, 224, 305, 408, 519, 638
  • 11, 33, 60, 104, 158, 226, 321, 423, 518, 656
span 1 {1 1 1}