نانوشیمی کوانتومی، جلد سوم: مولکول‌های کوانتومی و واکنش‌پذیری

Volume 3 of the 5-volume Quantum Nanochemistry presents the chemical reactivity throughout the molecular structure in general and chemical bonding in particular by introducing the bondons as the quantum bosonic particles of the chemical field, localization, from Hückel to Density Functional expositions, especially in relation to how chemical principles of electronegativity and chemical hardness decide the global chemical reactivity and interaction. The volume presents the fundamental and advanced concepts, principles, and models as well as their first and novel combinations and applications in quantum (physical) chemical theory of bonding, molecular reactivity, and aromaticity This volume presents the fundamental and advanced concepts, principles, and models, as well as their first and novel combinations and applications, in quantum (physical) chemical theories of bonding, molecular reactivity and aromaticity. Volume 3 of the 5-volume Quantum Nanochemistry presents the chemical reactivity throughout the molecular structure in general and chemical bonding in particular by introducing the bondons as the quantum bosonic particles of the chemical field, localization, from Hckel to Density Functional expositions, especially in relation to how chemical principles of electronegativity and chemical hardness decide the global chemical reactivity and interaction. The volume presents the fundamental and advanced concepts, principles, and models as well as their first and novel combinations and applications in quantum (physical) chemical theory of bonding, molecular reactivity, and aromaticity Volume 3 of the 5-volume Quantum Nanochemistry presents the chemical reactivity throughout the molecular structure in general and chemical bonding in particular by introducing the bondons as the quantum bosonic particles of the chemical field, localization, from Hückel to Density Functional expositions, especially in relation to how chemical principles of electronegativity and chemical hardness decide the global chemical reactivity and interaction. The volume presents the fundamental and advanced concepts, principles, and models as well as their first and novel combinations and applications in quantum (physical) chemical theory of bonding, molecular reactivity, and aromaticity "This new 5-volume series presents in a balanced yet progressive manner the fundamental and advanced concepts, principles, and models of quanta, atoms, molecules, solids and crystal and chemical-biological interaction in cells. It also addresses are the first and novel combinations and applications in modeling complex natural or designed phenomena. These new volumes embrace the best knowledge at the dawn of the 21st century of chemical bonding approaches while further advancing the chemical bonding approaches through the author's own progressive vision, which highlights the concept of bosonic-bondon in artificial chemistry"-- Provided by publisher Content: Front Cover CONTENTS List of Abbreviations Preface to Five-Volume Set About the Author Foreword to Volume III: Quantum Molecule and Reactivity Preface to Volume III: Quantum Molecule and Reactivity Chapter 1. Modern Quantum Nature of the Chemical Bond: Valence, Orbitals and Bondons Chapter 2. Molecular Structure by Quantum Chemistry Chapter 3. Quantum Chemical Reactivity of Atoms-in-Molecules Chapter 4. Modeling Molecular Aromaticity Back Cover volume 1. Quantum theory and observability volume 2. Quantum atoms and periodicity volume 3. Quantum molecules and reactivity volume 4. Quantum solids and orderability volume 5. Quantum structure-activity relationships (Qu-SAR).