Computational physics

Molecular dynamics simulations are a widely used computational tool in physics. One can model gases, supercooled liquids, proteins, etc....

Here we'll see how the Lattice-Spring Model (see Computational simulations of dynamical systems) can be used to simulate the dynamics of...

The Density Functional Theory (DFT) predicts a variety of chemical and physical properties, such as molecular structures, vibrational...

In the study of molecular dynamics simulations, having methods to characterize local structural order of the constituents of the system...

Machine learning is a fast growing field in computational sciences and data analysis. Its recent growing has been related to big data,...