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Lecture notes on theoretical chemistry
This lecture note set deals with basic issues in theoretical chemistry, such as specific gravity, chemical nomenclature, atomic structure, and chemical bonding. The set focuses on fundamental concepts in molecular chemistry, such as chemical equations, the periodic law, and behavior of gases. The purpose is to develop a robust understanding of the core topics from which deeper study is pursued in theoretical chemistry, serving as an introduction for students at all levels.
Author(s): Ferdinand Gerhard Wiechmann
NA Pages 
Theoretical Chemistry by Jack Simons
It describes in detail the role of theory in chemistry. Key concepts covered include chemical kinetics, oxidation numbers, electronegativity, and application of various theoretical methods like quantum dynamics and classical Newtonian dynamics. This note also underlines the importance of an interface between the laboratory and theory inasmuch as experimental measurements interact with the theoretical models. It discusses advanced topics such as mixed classical and quantum dynamics, the Car-Parrinello method, and their applications to large biomolecules and polymers, giving insight into the scope and methods used in modern theoretical chemistry.
Author(s): Jack Simons, University of Utah
NA Pages
This guide is meant to provide easy access for chemistry students to develop necessary mathematical skills in a concise, at-hand fashion. It relates key mathematical concepts that commonly are applied in chemistry, in algebra, calculus, and statistical methods. The book presents mathematics as fundamental to solving problems in chemistry and for grasping more sophisticated ideas in physical chemistry, quantum mechanics, and molecular simulations. It is focused on enhancing the student's ability to apply mathematical tools in both theoretical and experimental contexts in chemistry.
Author(s): Allan Cunningham and Rory Whelan
119 Pages