Crystal Structure - Unit Cell

Unit Cell

The crystal structure of a material or the arrangement of atoms within a given type of crystal structure can be described in terms of its unit cell. The unit cell is a small box containing one or more atoms, a spatial arrangement of atoms. The unit cells stacked in three-dimensional space describe the bulk arrangement of atoms of the crystal. The crystal structure has a three-dimensional shape. The unit cell is given by its lattice parameters, which are the length of the cell edges and the angles between them, while the positions of the atoms inside the unit cell are described by the set of atomic positions (xi, yi, zi) measured from a lattice point.


  • Simple cubic (P)

  • Body-centered cubic (I)

  • Face-centered cubic (F)

Within the unit cell is the asymmetric unit, smallest unit the crystal can be divided into using the crystallographic symmetry operations of the space group. The asymmetric unit is also what is generally solved when solving a structure of a molecule or protein by X-ray crystallography.

Read more about this topic:  Crystal Structure

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