Python for Chemists

"Python for Chemists" is a comprehensive technical book that offers an accessible and self-contained introduction to the Python programming language, with a particular focus on applications in chemistry and chemical physics. It is aimed at students and researchers in chemistry who want to use Python to solve problems in their research. The book begins with the fundamental concepts of the programming language and then progresses to advanced topics and applications in chemistry. The necessary syntax and data structures are clearly explained and applied to practical problems. Additionally, common numerical packages such as NumPy, SciPy, Matplotlib, SymPy, and pandas are described in detail. At the end of each chapter, there are exercises for which solutions are provided in the book. Supplementary resources, datasets, and Jupyter Notebooks are available on a companion website to deepen understanding and apply knowledge practically.