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Crystal Structure
SSRN Electronic Journal
The Structure and Migration of Twin Boundaries in Tetragonal β-Sn: An Application of Machine Learning Based Interatomic Potentials
2025
Article

Crystal Structure

Ordered arrangement of atoms, ions, or molecules in a crystalline material

In crystallography, crystal structure is a description of the ordered arrangement of atoms, ions, or molecules in a crystalline material. Ordered structures occur from the intrinsic nature of the constituent particles to form symmetric patterns that repeat along the principal directions of three- dimensional space in matter.

The smallest group of particles in the material that constitutes this repeating pattern is the unit cell of the structure. The unit cell completely reflects the symmetry and structure of the entire crystal, which is built up by repetitive translation of the unit cell along its principal axes. The translation vectors define the nodes of the Bravais lattice.

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SSRN Electronic Journal
The Structure and Migration of Twin Boundaries in Tetragonal β-Sn: An Application of Machine Learning Based Interatomic Potentials
2025
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