Quantum Chemistry

By Sanjay Kumar Jasrotia, Edited by Alexander Gardner

Quantum chemistry is a branch of chemistry that applies the principles of quantum mechanics to understand and predict the behavior of atoms and molecules at the subatomic level. Unlike classical chemistry, which deals with observable phenomena, quantum chemistry explores how electrons and nuclei interact through wavefunctions, probability distributions, and discrete energy levels. The core foundation of quantum chemistry lies in the Schrödinger equation, which describes the quantum state of a system and allows chemists to calculate molecular structures, bond energies, and spectral properties. One of the major achievements of quantum chemistry is its ability to explain chemical bonding through concepts like atomic orbitals, molecular orbitals, and hybridization. The theory accurately describes the formation of covalent bonds, electronic transitions, and resonance structures. Additionally, computational quantum chemistry uses numerical methods and algorithms to simulate complex molecular systems, making it a vital tool in drug design, materials science, and nanotechnology. Quantum chemistry bridges the gap between theoretical physics and practical chemistry, offering a deep understanding of reaction mechanisms, electron distributions, and molecular behavior. By describing nature at its most fundamental level, it provides insight into phenomena such as tunneling, spin, and entanglement, which are essential for advancements in modern chemistry, quantum computing, and spectroscopy. Quantum Chemistry explores the fundamental principles of quantum mechanics as applied to the behavior and interaction of atoms and molecules. Contents: 1. Introduction to Quantum Chemistry, 2. Thermodynamic Laws, 3. Chemical Rates and Quantum Mechanisms, 4. Lewis Structures of Molecules, 5. Quantum Mechanics and Wave Mechanics, 6. Rate Law and Reaction Mechanism, 7. The Structure of the Atom and Electron, 8. The Quantum Theory.

Sanjay Kumar Jasrotia has done M.Sc. and M.Phil. (Chemistry) from Himachal Pradesh University, Shimla (H.P.). He has been actively engaged in Education since 1997 in different Govt. Colleges of Himachal Pradesh like Govt. College Chamba, Govt. College Dehri, Govt. College Dharamsala and Govt Arya Degree College Nurpur. He also participated in National and International conferences. He also had participated in many administrative works at college level. He has worked as a supervisor as well as a coordinator in university evaluation. He is Disciplinarian and active member in various cultural programmes and sports activities. He always kept himself busy in teaching and writing in his core subjects. At present, he is working as an Associate professor & Head, Department of Chemistry at Govt. Arya Degree College, Nurpur (H.P.) and giving his updates in teaching from last twenty five years.

ISBN978-1-83693-800-2
Copyright Year2027
Price$ 174
LanguageEnglish
FormatPDF
CategoryChemistry