Principles And Applications Of Quantum Chemistry
Download Principles And Applications Of Quantum Chemistry full books in PDF, epub, and Kindle. Read online free Principles And Applications Of Quantum Chemistry ebook anywhere anytime directly on your device. Fast Download speed and no annoying ads. We cannot guarantee that every ebooks is available!
Principles and Applications of Quantum Chemistry
Author | : V.P. Gupta |
Publsiher | : Academic Press |
Total Pages | : 478 |
Release | : 2015-10-15 |
Genre | : Science |
ISBN | : 9780128035016 |
Download Principles and Applications of Quantum Chemistry Book in PDF, Epub and Kindle
Principles and Applications of Quantum Chemistry offers clear and simple coverage based on the author’s extensive teaching at advanced universities around the globe. Where needed, derivations are detailed in an easy-to-follow manner so that you will understand the physical and mathematical aspects of quantum chemistry and molecular electronic structure. Building on this foundation, this book then explores applications, using illustrative examples to demonstrate the use of quantum chemical tools in research problems. Each chapter also uses innovative problems and bibliographic references to guide you, and throughout the book chapters cover important advances in the field including: Density functional theory (DFT) and time-dependent DFT (TD-DFT), characterization of chemical reactions, prediction of molecular geometry, molecular electrostatic potential, and quantum theory of atoms in molecules. Simplified mathematical content and derivations for reader understanding Useful overview of advances in the field such as Density Functional Theory (DFT) and Time-Dependent DFT (TD-DFT) Accessible level for students and researchers interested in the use of quantum chemistry tools
Principles of Quantum Chemistry
Author | : David V. George |
Publsiher | : Elsevier |
Total Pages | : 284 |
Release | : 2013-10-22 |
Genre | : Science |
ISBN | : 9781483278551 |
Download Principles of Quantum Chemistry Book in PDF, Epub and Kindle
Principles of Quantum Chemistry focuses on the application of quantum mechanics in physical models and experiments of chemical systems. This book describes chemical bonding and its two specific problems — bonding in complexes and in conjugated organic molecules. The very basic theory of spectroscopy is also considered. Other topics include the early development of quantum theory; particle-in-a-box; general formulation of the theory of quantum mechanics; and treatment of angular momentum in quantum mechanics. The examples of solutions of Schroedinger equations; approximation methods in quantum chemistry; symmetry in chemistry; and molecular-orbital theory are also covered. This publication is recommended for students taking undergraduate and graduate courses in quantum chemistry.
The Principles of Quantum Mechanics
Author | : Paul Adrien Maurice Dirac |
Publsiher | : Oxford University Press |
Total Pages | : 340 |
Release | : 1981 |
Genre | : Science |
ISBN | : 0198520115 |
Download The Principles of Quantum Mechanics Book in PDF, Epub and Kindle
The first edition of this work appeared in 1930, and its originality won it immediate recognition as a classic of modern physical theory. The fourth edition has been bought out to meet a continued demand. Some improvements have been made, the main one being the complete rewriting of the chapter on quantum electrodymanics, to bring in electron-pair creation. This makes it suitable as an introduction to recent works on quantum field theories.
Quantum Chemistry of Solids
Author | : Robert A. Evarestov |
Publsiher | : Springer Science & Business Media |
Total Pages | : 559 |
Release | : 2007-08-16 |
Genre | : Science |
ISBN | : 9783540487487 |
Download Quantum Chemistry of Solids Book in PDF, Epub and Kindle
This book delivers a comprehensive account of the main features and possibilities of LCAO methods for the first principles calculations of electronic structure of periodic systems. The first part describes the basic theory underlying the LCAO methods applied to periodic systems and the use of wave-function-based, density-based (DFT) and hybrid hamiltonians. The second part deals with the applications of LCAO methods for calculations of bulk crystal properties.
Quantum Theory for Chemical Applications
Author | : Jochen Autschbach |
Publsiher | : Oxford University Press, USA |
Total Pages | : 756 |
Release | : 2020-09-17 |
Genre | : Science |
ISBN | : 9780190920807 |
Download Quantum Theory for Chemical Applications Book in PDF, Epub and Kindle
"Quantum Theory for Chemical Applications (QTCA) Quantum theory, or more specifically, quantum mechanics is endlessly fascinating, curious & strange, and often considered to be difficult to learn. It is true that quantum mechanics is a mathematical theory. Its scope, its predictions, the wisdom we gain from its results, all these become fully clear only in the context of the relevant equations and calculations. But the study of quantum mechanics is definitely worth the effort, and - as I like to tell my students- it is not rocket science"--
Introduction to Quantum Mechanics with Applications to Chemistry
Author | : Linus Pauling,E. Bright Wilson |
Publsiher | : Courier Corporation |
Total Pages | : 496 |
Release | : 2012-06-08 |
Genre | : Science |
ISBN | : 9780486134932 |
Download Introduction to Quantum Mechanics with Applications to Chemistry Book in PDF, Epub and Kindle
Classic undergraduate text explores wave functions for the hydrogen atom, perturbation theory, the Pauli exclusion principle, and the structure of simple and complex molecules. Numerous tables and figures.
Quantum Mechanics Principles and Applications
![Quantum Mechanics Principles and Applications](https://youbookinc.com/wp-content/uploads/2024/06/cover.jpg)
Author | : Marcelo Alonso |
Publsiher | : Unknown |
Total Pages | : 641 |
Release | : 1973 |
Genre | : Quantum theory |
ISBN | : OCLC:557605364 |
Download Quantum Mechanics Principles and Applications Book in PDF, Epub and Kindle
Quantum Chemistry
Author | : Tamás Veszprémi,Miklós Fehér |
Publsiher | : Springer Science & Business Media |
Total Pages | : 381 |
Release | : 2012-12-06 |
Genre | : Science |
ISBN | : 9781461541899 |
Download Quantum Chemistry Book in PDF, Epub and Kindle
`Quantum Chemistry [the branch of Computational Chemistry that applies the laws of Quantum Mechanics to chemical systems] is one of the most dynamic fields of contemporary chemistry, providing a solid foundation for all of chemistry, and serving as the basis for practical, computational methodologies with applications in virtually all branches of chemistry ... The increased sophistication, accuracy and scope of the theory of chemistry are due to a large extent to the spectacular development of quantum chemistry, and in this book the authors have made a remarkable effort to provide a modern account of the field.' From the Foreword by Paul Mezey, University of Saskatchewan. Quantum Chemistry: Fundamentals to Applications develops quantum chemistry all the way from the fundamentals, found in Part I, through the applications that make up Part II. The applications include: molecular structure; spectroscopy; thermodynamics; chemical reactions; solvent effects; and excited state chemistry. The importance of this field is underscored by the fact that the 1998 Nobel Prize in Chemistry was awarded for the development of Quantum Chemistry.