Structure 1548810

1548809 << 1548810 >> 1548811
Original COD entry Download CIF Download DOT

Citation: Zhao, Qing; Kulik, Heather J. (2018). Where Does the Density Localize in the Solid State? Divergent Behavior for Hybrids and DFT+U.. Journal of chemical theory and computation, , pp. -.

Formula: Co H2 O2

Chemical name: Cobalt hydroxide

Cell parameters:

  • a = 3.186(1) Å
  • b = 3.186(1) Å
  • c = 4.653(1) Å
  • α = 90.°
  • β = 90.°
  • γ = 120.°

List type: noninterleaving

List: 2D

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)

Dimensionality: 2

Formula: Co H2 O2 (Co H2 O2)

Multiplicity: 1

Coordination sequences:

  • 1, 3, 12, 21, 24, 39, 36, 57, 48, 75
  • 4, 12, 21, 24, 39, 36, 57, 48, 75, 60
  • 6, 12, 18, 30, 30, 48, 42, 66, 54, 84
span 1 {1 1 1}