Atomistic Modeling

Atomistic modeling is a scientific approach that simulates how individual atoms and molecules behave and interact to understand the properties of materials and systems. Using computer algorithms, it predicts how atoms arrange themselves, move, and respond under different conditions. This method allows researchers to study the structure, stability, and dynamics of materials at a very detailed level, aiding in the design of new substances, drugs, or nanotechnology devices without needing physical experiments. Essentially, it provides a virtual window into the microscopic world of atoms, offering insights that are often difficult to observe directly.