Structure 1535826

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Original COD entry Download CIF Download DOT

Citation: Calvert, L.D.; Gainsford, G.J.; Murray, J.J.; Taylor, J.B. (1984). Crystal structure of Ca Ni5 H using X-Ray diffraction with in situ hydriding. Materials Research Bulletin, 19, pp. 107-113.

Formula: Ca H1.06 Ni5

Chemical name: Ca Ni5 H1.06

Cell parameters:

  • a = 8.6044 Å
  • b = 5.0965 Å
  • c = 7.8395 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: Ca4 Ni20 (Ca Ni5)

Multiplicity: 1

Coordination sequences:

  • 2, 14, 38, 94, 144, 230, 298, 450, 524, 710
  • 2, 14, 40, 94, 150, 240, 318, 442, 562, 704
  • 8, 30, 64, 126, 186, 286, 364, 510, 608, 800
  • 9, 27, 67, 121, 191, 275, 377, 499, 619, 779
  • 9, 29, 71, 118, 198, 273, 387, 480, 644, 757
  • 10, 28, 71, 121, 198, 264, 391, 485, 646, 752
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