Undergraduate → Solid state physics ↓
Crystal structure
In solid state physics, the concept of crystal structure is important. It is the cornerstone of understanding how materials behave at the microscopic level. Understanding crystal structures involves understanding the arrangement of atoms within a solid. This arrangement determines many properties of the material, such as electrical conductivity, magnetism, and optical properties.
Basic concepts
A crystal is a solid material whose atoms are arranged in a highly ordered, repeating pattern. This pattern extends in all three spatial dimensions. The smallest unit of this structure, which can be repeated without any change, is known as the unit cell. Unit cells can be thought of as the building blocks of a crystal.
To visualize a crystal structure, imagine a three-dimensional grid (like graph paper in 3D), where each intersection point represents an atomic position. The unit cell is a small box that can completely tile this grid by translation.
Forged
The concept of a lattice is central to understanding crystal structures. A lattice is a regular, repeating arrangement of points in space. Each point represents one or more atoms. In solid state physics, we classify lattices based on how the atoms are arranged in three-dimensional space.
The simple diagram above shows a 2D lattice, where the dots are lattice points, and these can be connected to atoms. Each line is a connection from a point to its neighbour, showing the regular pattern.
Unit cell
In crystallography, the purpose of the unit cell is to describe the crystal structure. Each unit cell contains not only the arrangement of atoms, but also the symmetry and dimensions of the crystal. The angles between the edges of the unit cell and the lengths of these edges are the main aspects that define its geometry.
The image above shows a 2D representation of a unit cell, where a red atom is placed at the center. In a 3D representation, you would expect to see identical layers stacked on top of each other.
Crystal systems and Bravais lattices
In three dimensions, crystals are classified into seven crystal systems, which describe the shape of the unit cell:
- Cube
- Square
- Orthorhombic
- Hexagonal
- Mainly rava
- Monoclinic
- Triclinic
Each of these systems is defined by specific restrictions on the angles and lengths of the unit cell edges. In addition to these seven crystal systems, Auguste Bravais identified 14 unique three-dimensional lattices, known as Bravais lattices.
Example: cubic system
The cubic crystal system is characterized by a unit cell where all sides are equal in length, and all angles are 90 degrees. Within this system, there are several types of lattice arrangements, which are usually referred to as:
- Simple Cube (SC)
- Body-centered cubic (BCC)
- Face-centered cube (FCC)
Simple Cube
In a simple cubic lattice, the atoms are located at each corner of the cube:
This simple layout allows us to see how repeating unit cells fit together to form larger structures, although simple cubicity is not common in natural crystals.
Body-centered cubic (BCC)
The BCC arrangement has atoms at each cube corner and an additional atom at the center of the cube. This structure is denser than a simple cube.
Visual example of BCC
In the BCC lattice, you can see how the central atom (in red) maximizes the space utilization of the unit cell.
Face-centered cubic (FCC)
The FCC arrangement places atoms at the corner of each cube and at the center of each face of the cube. This is the densest arrangement.
Visual example of FCC
The face-centered cubic lattice uses intermediate states to fill more space, making this structure common in metals such as aluminum and copper.
Density calculation
The atomic packing factor (APF) is a measure of the density of atoms within the lattice. It is calculated as:
APF = (Volume of atoms in a unit cell) / (Total volume of unit cell)
For the FCC structures, the APF is about 0.74, which shows that it has a higher density compared to the BCC structure, which has an APF of about 0.68.
Each type of crystal lattice has unique properties, such as strength, ductility, and conductivity. These properties result from the way the atoms are packed and their corresponding interactions.
Anisotropic
Crystals often exhibit anisotropy, meaning that their properties differ depending on the direction of measurement. For example, atomic arrangements along different axes in a crystal can lead to differences in physical or mechanical properties.
Materials with a face-centered cubic structure are more isotropic, while materials with less regular symmetry, such as monoclinic or triclinic, can exhibit significant asymmetry.
Defects in the crystal structure
No crystal is perfect. Imperfections can significantly affect the properties of a material. Common defects include:
- Point defects such as vacancies and interstitials
- Line defects, such as dislocations
- Planar defects, such as grain boundaries
These imperfections can affect the material’s strength, electrical conductivity and optical properties.
Application
The understanding of crystal structures has important applications in many areas:
- Semiconductor manufacturing depends on precise crystal growth for materials such as silicon.
- Understanding materials in metallurgy to enhance their strength and ductility.
- Nanotechnology and the design of new materials at small scales.
Modern materials science relies heavily on crystallographic understanding, influencing technological advances from electronics to biotechnology.
Conclusion
The study of crystal structures in solid state physics provides profound insights into the physical world. From identifying basic unit cells to grappling with the intricacies of real-world crystalline defects, this subject provides a foundational perspective. It not only helps us unlock the potential of existing materials but also drives the development of new, advanced materials, impacting everything from industrial production to cutting-edge technology.