Structure 4002770

4002769 << 4002770 >> 4002771
Original COD entry Download CIF Download DOT

Citation: Wang, Zhenbin; Chu, Iek-Heng; Zhou, Fei; Ong, Shyue Ping (2016). Electronic Structure Descriptor for the Discovery of Narrow-Band Red-Emitting Phosphors. Chemistry of Materials, 28, pp. 4024-.

Formula: Ca16 Mg8 N48 Si24

Cell parameters:

  • a = 8.54796155 Å
  • b = 8.48306060 Å
  • c = 15.52767074 Å
  • α = 90.00000000°
  • β = 98.07650356°
  • γ = 90.00000000°

List type: interleaving

List: 2D

Combined 3D structure and graph

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JSmol combined CIF view

Linear Graph Knot

Molecules

CIF datablock 0, entity 1 of 2

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

Dimensionality: 2

Formula: Mg4 N24 Si12 (Mg N6 Si3)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 8, 15, 18, 34, 31, 52, 33, 56
  • 3, 9, 10, 20, 21, 38, 27, 46, 37, 62
  • 3, 9, 12, 23, 19, 34, 29, 50, 35, 58
  • 4, 6, 12, 13, 26, 28, 48, 28, 48, 44
  • 4, 6, 12, 16, 30, 24, 42, 32, 54, 40
  • 4, 8, 18, 16, 30, 24, 42, 32, 54, 40
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CIF datablock 1, entity 2 of 2

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

Dimensionality: 2

Formula: Mg4 N24 Si12 (Mg N6 Si3)

Multiplicity: 1

Coordination sequences:

  • 2, 6, 8, 15, 18, 34, 31, 52, 33, 56
  • 3, 9, 10, 20, 21, 38, 27, 46, 37, 62
  • 3, 9, 12, 23, 19, 34, 29, 50, 35, 58
  • 4, 6, 12, 13, 26, 28, 48, 28, 48, 44
  • 4, 6, 12, 16, 30, 24, 42, 32, 54, 40
  • 4, 8, 18, 16, 30, 24, 42, 32, 54, 40
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