Structure 1519662

1519661 << 1519662 >> 1519663
Original COD entry Download CIF Download DOT

Citation: Wiedemann, Dennis; Islam, Mazharul M.; Nakhal, Suliman; Senyshyn, Anatoliy; Bredow, Thomas; Lerch, Martin (2015). Lithium Diffusion Pathways in 3R-LixTiS2: A Combined Neutron Diffraction and Computational Study. The Journal of Physical Chemistry C, 119, pp. 11370-.

Formula: Li0.7 S2 Ti

Chemical name: lithium titanium disulfide (lithium deficient)

Cell parameters:

  • a = 3.49902(7) Å
  • b = 3.49902(7) Å
  • c = 18.6498(6) Å
  • α = 90°
  • β = 90°
  • γ = 120°

List type: interleaving

List: 2D

Combined 3D structure and graph

span 1 {1 1 1}
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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 3

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: S2 Ti (S2 Ti)

Multiplicity: 1

RCSR Symbol: kgd

Coordination sequences:

  • 3, 12, 9, 24, 15, 36, 21, 48, 27, 60
  • 6, 6, 18, 12, 30, 18, 42, 24, 54, 30
span 1 {1 1 1}

CIF datablock 1, entity 2 of 3

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: S2 Ti (S2 Ti)

Multiplicity: 1

RCSR Symbol: kgd

Coordination sequences:

  • 3, 12, 9, 24, 15, 36, 21, 48, 27, 60
  • 6, 6, 18, 12, 30, 18, 42, 24, 54, 30
span 1 {1 1 1}

CIF datablock 2, entity 3 of 3

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: S2 Ti (S2 Ti)

Multiplicity: 1

RCSR Symbol: kgd

Coordination sequences:

  • 3, 12, 9, 24, 15, 36, 21, 48, 27, 60
  • 6, 6, 18, 12, 30, 18, 42, 24, 54, 30
span 1 {1 1 1}