Titre :	Quantum Chemistry
Type de document :	document électronique
Auteurs :	Rao Prasada
Editeur :	Boca Raton : CRC Press
Année de publication :	2022
Importance :	1 vol (152 p.)
ISBN/ISSN/EAN :	978-1-00-081558-0
Langues :	Français (fre)
Catégories :	Bibliothèque numérique:Chimie
Mots-clés :	Quantum chemistry
Index. décimale :	541.28 Chimie quantique
Résumé :	Quantum Chemistry provides a coherent and structured approach in introducing the concept of'quantum'to the students of quantum mechanics. An attempt is made to bring out the subtleties of quantum mechanics, hidden in its abstract laws and equations, applicable to the atomic domain by showing its relevance to the observable macroscopic world as well. The book will help students dispel the stigma associated with quantum mechanics. The emphasis on conceptual approach provides a platform to stand on, and a stimulus to pursue higher quantum mechanics—the doorway to the all-pervasive quantum world. Print edition not for sale in South Asia (India, Sri Lanka, Nepal, Bangladesh, Pakistan or Bhutan).
Note de contenu :	Table of Contents Chapter 1 Historical Background 1.1 Newtonian Mechanics 1.2 Black Body Radiation 1.3 The Photoelectric Effect 1.4 The Compton Effect 1.5 Atomic Spectra 1.6 Atomic Models 1.7 The Bohr Atom 1.8 Failure of the Old Quantum Theory Chapter 2 The Wave Equation 2.1 de Broglie’s Concept of Matter Waves 2.2 Heisenberg’s Uncertainty Principle 2.3 Wave Equation 2.4 Interpretation of Wave Function 2.5 Normalized and Orthogonal Wave Functions 2.6 Exercises Chapter 3 The Postulates 3.1 The Formulation of Quantum Mechanics 3.2 The Postulates of Quantum Mechanics 3.3 Exercises Chapter 4 Applications of Schrödinger Equation-1 (Simple systems with constant potential energy) 4.1 Particle in a One-dimensional Box 4.2 The Particle in a Three Dimensional Box 4.3 The Structure of Matter 4.4 Factors Influencing Color 4.5 Tunneling in Quantum Mechanics 4.6 The Rigid Rotor Chapter 5 Applications of Schrödinger Equation-2 (Simple Systems with Variable Potential Energy) 5.1 One-dimensional Harmonic Oscillator 5.2 The Hydrogen Atom Chapter 6 Approximation Methods 6.1 Perturbation Theory 6.2 The Variational Method 6.3 The Hartree Theory 6.4 Exercises Chapter 7 Bonding in Molecules 7.1 Molecular Orbital Theory 7.2 Valence Bond Theory 7.3 Hybridization Chapter 8 Appendix 8.1 SI Units (Système International d’unités) 8.2 Derived Units 8.3 Supplementary Units 8.4 CGS Units 8.5 Prefix Dictionary 8.6 Experimental Foundation 8.7 Calculation of Effective Nuclear Charge 8.8 Approximate Orbitals 8.9 Angular Momentum 8.10 Laplacian Operator 8.11 Supplement to Rigid Rotor 8.12 Supplement to One-dimensional Harmonic Oscillator
Côte titre :	E-Fs/0012
En ligne :	https://sciences-courses.univ-setif.dz/login/index.php

Quantum Chemistry [document électronique] / Rao Prasada . - Boca Raton : CRC Press, 2022 . - 1 vol (152 p.).
ISBN : 978-1-00-081558-0
Langues : Français (fre)

Catégories :	Bibliothèque numérique:Chimie
Mots-clés :	Quantum chemistry
Index. décimale :	541.28 Chimie quantique
Résumé :	Quantum Chemistry provides a coherent and structured approach in introducing the concept of'quantum'to the students of quantum mechanics. An attempt is made to bring out the subtleties of quantum mechanics, hidden in its abstract laws and equations, applicable to the atomic domain by showing its relevance to the observable macroscopic world as well. The book will help students dispel the stigma associated with quantum mechanics. The emphasis on conceptual approach provides a platform to stand on, and a stimulus to pursue higher quantum mechanics—the doorway to the all-pervasive quantum world. Print edition not for sale in South Asia (India, Sri Lanka, Nepal, Bangladesh, Pakistan or Bhutan).
Note de contenu :	Table of Contents Chapter 1 Historical Background 1.1 Newtonian Mechanics 1.2 Black Body Radiation 1.3 The Photoelectric Effect 1.4 The Compton Effect 1.5 Atomic Spectra 1.6 Atomic Models 1.7 The Bohr Atom 1.8 Failure of the Old Quantum Theory Chapter 2 The Wave Equation 2.1 de Broglie’s Concept of Matter Waves 2.2 Heisenberg’s Uncertainty Principle 2.3 Wave Equation 2.4 Interpretation of Wave Function 2.5 Normalized and Orthogonal Wave Functions 2.6 Exercises Chapter 3 The Postulates 3.1 The Formulation of Quantum Mechanics 3.2 The Postulates of Quantum Mechanics 3.3 Exercises Chapter 4 Applications of Schrödinger Equation-1 (Simple systems with constant potential energy) 4.1 Particle in a One-dimensional Box 4.2 The Particle in a Three Dimensional Box 4.3 The Structure of Matter 4.4 Factors Influencing Color 4.5 Tunneling in Quantum Mechanics 4.6 The Rigid Rotor Chapter 5 Applications of Schrödinger Equation-2 (Simple Systems with Variable Potential Energy) 5.1 One-dimensional Harmonic Oscillator 5.2 The Hydrogen Atom Chapter 6 Approximation Methods 6.1 Perturbation Theory 6.2 The Variational Method 6.3 The Hartree Theory 6.4 Exercises Chapter 7 Bonding in Molecules 7.1 Molecular Orbital Theory 7.2 Valence Bond Theory 7.3 Hybridization Chapter 8 Appendix 8.1 SI Units (Système International d’unités) 8.2 Derived Units 8.3 Supplementary Units 8.4 CGS Units 8.5 Prefix Dictionary 8.6 Experimental Foundation 8.7 Calculation of Effective Nuclear Charge 8.8 Approximate Orbitals 8.9 Angular Momentum 8.10 Laplacian Operator 8.11 Supplement to Rigid Rotor 8.12 Supplement to One-dimensional Harmonic Oscillator
Côte titre :	E-Fs/0012
En ligne :	https://sciences-courses.univ-setif.dz/login/index.php