Download or read book Introduction la chimie quantique written by Claude Leforestier and published by . This book was released on 2005 with total page 446 pages. Available in PDF, EPUB and Kindle. Book excerpt: Ce manuel énonce, de manière progressive, les principaux concepts quantiques qui sont nécessaires à la compréhension des descriptions microscopiques sur les phénomènes chimiques et plus particulièrement sur les liaisons chimiques. En effet, la chimie évolue vers des méthodes d'investigation (microscopie à champ de force, spectroscopies RMN, LEED, modélisation moléculaire...) dont les données demandent une bonne assimilation des concepts quantiques. Cet ouvrage s'adresse aux étudiants en 2e cycle/Master de chimie, de chimie-physique et de sciences physiques. Des exemples et des exercices tirés de cas rencontrés en chimie sont proposés afin d'accompagner l'étudiant dans son apprentissage du monde quantique. Les notions mathématiques de base sont rappelées en annexes et les solutions développées sont disponibles sur Internet.
Download or read book Introduction la chimie quantique written by Philippe Hiberty and published by Editions Ecole Polytechnique. This book was released on 2008 with total page 324 pages. Available in PDF, EPUB and Kindle. Book excerpt: Présentation de la théorie des orbites moléculaires et des modèles simples qui lui sont associés : théorie de Hückel, modèle des orbitales frontières, diagrammes de corrélation, méthode des orbitales de fragments, etc. Montre les liens entre la théorie des orbitales moléculaires et la théorie de liaison de valence.--[Memento].
Download or read book Introduction la chimie quantique written by Philippe C.. Hiberty and published by . This book was released on 2001 with total page 284 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Introduction la chimie quantique et la spectroscopie written by Gilles Durocher and published by . This book was released on 1976* with total page 1128 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book M thodes math matiques en chimie quantique Une introduction written by Eric Cances and published by Springer Science & Business Media. This book was released on 2006-02-09 with total page 419 pages. Available in PDF, EPUB and Kindle. Book excerpt: Ce cours est une introduction à la modélisation mathématique et à l'analyse numérique pour la chimie moléculaire quantique, un champ peu connu des mathématiciens et pourtant riche en sujets d'investigation. Le point de vue choisi est celui du mathématicien appliqué. Le cours est construit de manière auto-consistante.
Download or read book Introduction la chimie quantique et la spectroscopie written by Gilles Durocher and published by Presses de l'Université de Montréal. This book was released on 1971 with total page 290 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book l ments de chimie quantique l usage des chimistes 2e dition written by Jean-Louis Rivail and published by EDP Sciences. This book was released on 2012-12-03T00:00:00+01:00 with total page 461 pages. Available in PDF, EPUB and Kindle. Book excerpt: Les concepts fondamentaux ainsi qu'une présentation en détail de la notion d'orbitales atomiques et moléculaires et de ses applications à divers problèmes. L'ouvrage s'adresse aux ingénieurs, aux étudiants de fin de 2e cycle et de 3e cycle, aux chimistes professionnels de l'industrie et aux chercheurs en chimie expériementale.
Download or read book Introduction la chimie quantique written by Philippe Hiberty and published by . This book was released on 2006 with total page 300 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Cours de chimie physique written by Roger Lacroix (chimiste.) and published by . This book was released on 198? with total page 194 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Chimie quantique written by Claude Millot and published by . This book was released on 2000 with total page 208 pages. Available in PDF, EPUB and Kindle. Book excerpt: Cet ouvrage s'adresse aux étudiants de second cycle universitaire en chimie physique, chimie, sciences physiques ou physique, ainsi qu'aux étudiants de troisième cycle désireux d'acquérir ou de revoir les bases de la chimie quantique. Après une introduction à la mécanique quantique, il aborde les diverses méthodes permettant d'élucider la structure électronique de la matière : utilisation de la symétrie moléculaire pour la description de la structure des molécules et l'obtention de diagramme d'orbitales moléculaires, théorie des bandes électroniques dans les solides, symétrie des états multi-électroniques, spectroscopie, méthodes de Hartree-Fock et postHartree-Fock... Chaque chapitre débute par de brefs rappels des points de cours concernés, qui introduisent de nombreux exercices et problèmes corrigés, visant à faciliter l'assimilation des concepts. Les corrigés, souvent détaillés, ont été délibérément séparés des énoncés pour inciter le lecteur à résoudre les exercices avant d'en lire les solutions.
Download or read book Introduction to the Quantum World of Atoms and Molecules written by Jens Peder Dahl and published by World Scientific. This book was released on 2001 with total page 480 pages. Available in PDF, EPUB and Kindle. Book excerpt: This invaluable book provides a balanced and integrated introduction to the quantum world of atoms and molecules. The underlying basis of quantum mechanics is carefully developed, with respect for the historical tradition and from a molecular angle. The fundamental concepts in the theory of atomic and molecular structure are thoroughly discussed, as are the central techniques needed in quantum-chemical applications. Special attention is paid to exposing and clarifying the common ground of Hartree?Fock theory and density-functional theory. Throughout the text, the discussion is pedagogically obliging and aims at simplicity and mathematical clarity, while avoiding the use of advanced mathematics. End-of-chapter problems supplement the main text.
Download or read book Quantum Chemistry written by Walter Kauzmann and published by Elsevier. This book was released on 2013-10-22 with total page 757 pages. Available in PDF, EPUB and Kindle. Book excerpt: Quantum Chemistry: An Introduction provides information pertinent to the fundamental aspects of quantum mechanics. This book presents the theory of partial differentiation equations by using the classical theory of vibrations as a means of developing physical insight into this essential branch of mathematics. Organized into five parts encompassing 16 chapters, this book begins with an overview of how quantum mechanical deductions are made. This text then describes the achievements and limitations of the application of quantum mechanics to chemical problems. Other chapters provide a brief survey of some essential properties of the associated Legendre functions. The final chapter deals with the Franck-Condon principle, which states that transitions tend to occur between vibrational levels of two different electronic states for which either the minimum or maximum values of the internuclear distance in the potential energy diagram occur with the same nuclear configuration. This book is a valuable resource for chemists.
Download or read book Introduction to Quantum Mechanics written by S.M. Blinder and published by Academic Press. This book was released on 2020-10-09 with total page 436 pages. Available in PDF, EPUB and Kindle. Book excerpt: Introduction to Quantum Mechanics, 2nd Edition provides an accessible, fully updated introduction to the principles of quantum mechanics. It outlines the fundamental concepts of quantum theory, discusses how these arose from classic experiments in chemistry and physics, and presents the quantum-mechanical foundations of current scientific developments.Beginning with a solid introduction to the key principles underpinning quantum mechanics in Part 1, the book goes on to expand upon these in Part 2, where fundamental concepts such as molecular structure and chemical bonding are discussed. Finally, Part 3 discusses applications of this quantum theory across some newly developing applications, including chapters on Density Functional Theory, Statistical Thermodynamics and Quantum Computing.Drawing on the extensive experience of its expert author, Introduction to Quantum Mechanics, 2nd Edition is a lucid introduction to the principles of quantum mechanics for anyone new to the field, and a useful refresher on fundamental knowledge and latest developments for those varying degrees of background. - Presents a fully updated accounting that reflects the most recent developments in Quantum Theory and its applications - Includes new chapters on Special Functions, Density Functional Theory, Statistical Thermodynamics and Quantum Computers - Presents additional problems and exercises to further support learning
Download or read book Quantum Chemistry written by Ajit J Thakkar and published by Morgan & Claypool Publishers. This book was released on 2014-06-01 with total page 124 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book is designed to help the non-specialist user of spectroscopic measurements and electronic structure computations to achieve a basic understanding of the underlying concepts of quantum chemistry. The book can be used to teach introductory quantum c
Download or read book Exploring Aspects of Computational Chemistry written by Jean-Marie André and published by Presses universitaires de Namur. This book was released on 1997 with total page 262 pages. Available in PDF, EPUB and Kindle. Book excerpt: Pris ensemble, les deux volumes offrent une introduction théorique et pratique à la chimie quantique statistique. Ce livre s'adresse à un public spécialisé : étudiants de licence, doctorants, chercheurs...
Download or read book Quantum Chemistry written by Michael Springborg and published by Walter de Gruyter GmbH & Co KG. This book was released on 2021-09-07 with total page 350 pages. Available in PDF, EPUB and Kindle. Book excerpt: This textbook introduces the reader to quantum theory and quantum chemistry. The textbook is meant for 2nd – 3rd year bachelor students of chemistry or physics, but also for students of related disciplines like materials science, pharmacy, and bioinformatics. At first, quantum theory is introduced, starting with experimental results that made it inevitable to go beyond classical physics. Subsequently, the Schrödinger equation is discussed in some detail. Some few examples for which the Schrödinger equation can be solved exactly are treated with special emphasis on relating the results to real systems and interpreting the mathematical results in terms of experimental observations. Ultimately, approximate methods are presented that are used when applying quantum theory in the field of quantum chemistry for the study of real systems like atoms, molecules, and crystals. Both the foundations for the different methods and a broader range of examples of their applications are presented. The textbook assumes no prior knowledge in quantum theory. Moreover, special emphasis is put on interpreting the mathematical results and less on an exact mathematical derivations of those. Finally, each chapter closes with a number of questions and exercises that help in focusing on the main results of the chapter. Many of the exercises include answers.
Download or read book Introduction to Quantum Mechanics with Applications to Chemistry written by Linus Pauling and published by Courier Corporation. This book was released on 2012-06-08 with total page 500 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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.
