Explore the basic concepts of how chemical reactions occur and the factors affecting them.
Understand how rate laws define the speed of reactions and their dependence on concentrations.
Explore how computer simulations aid in understanding complex reaction pathways.
Delve into the step-by-step processes through which reactions occur.
"The study of reaction kinetics has revolutionized our understanding of how and why reactions happen."
LAMMPS is a classical molecular dynamics code, and an acronym for Large-scale Atomic/Molecular Massively Parallel Simulator. You can visit the official website of LAMMPS at https://www.lammps.org to download the code and learn how to use it.
The study the controlled degradation and erosion of polymer networks at the mesoscale by Vaibhav Palkar and Olga Kuksenok. You can visit the following website to download the entire paper: https://pubs.acs.org/doi/full/10.1021/acs.jpcb.1c09570.
The objective of this tutorial is to use LAMMPS to perform a simple molecular dynamics simulation. You can download the code from this website: https://github.com/lammpstutorials/lammpstutorials.github.io/tree/version2.0 to learn and practice the process, calculations, and methods of LAMMPS modeling.