Chemical Reactivity and the Shape Function / Chapter 1: |
Density Functional Theory Models of Reactivity Based on an Energetic Criterion / Chapter 2: |
The Breakdown of the Maximum Hardness and Minimum Polarizability Principles for Nontotally Symmetric Vibrations / Chapter 3: |
Classification of Control Space Parameters for Topological Studies of Reactivity and Chemical Reactions / Chapter 4: |
Understanding and Using the Electron Localization Function (ELF) / Chapter 5: |
Electronic Structure and Reactivity in Double of Rydberg Anions: Characterization of a Novel Kind of Electron Pair / Chapter 6: |
Using the Reactivity-Selectivity Descriptor Dgr;f(r)in Organic Chemistry / Chapter 7: |
The Average Local Ionization Energy: Concepts and Applications / Chapter 8: |
The Electrophilicity Index in Organic Chemistry / Chapter 9: |
Electronic Structure and Reactivity of Aromatic Metal Clusters / Chapter 10: |
Small Gold Clusters Form Nonconventional Hydrogen Bonds X-H-Au: Gold-Water Clusters as Example / Chapter 11: |
Theoretical Design of Electronically Stabilized Molecules Containing Planar Tetracoordinate Carbons / Chapter 12: |
Chemical Reactivity Dynamics in Ground and Excited Electronic States / Chapter 13: |
Quantum Chemical Topology and Reactivity: A Comparative Static and Dynamic Study on a S N 2 Reaction / Chapter 14: |
1,4-Dihydropyridine Calcium Channel Blockers with Electronic Descriptors Produced by Quantum Chemical Topology / Chapter 15: |
Chemical Reactivity and the Shape Function / Chapter 1: |
Density Functional Theory Models of Reactivity Based on an Energetic Criterion / Chapter 2: |
The Breakdown of the Maximum Hardness and Minimum Polarizability Principles for Nontotally Symmetric Vibrations / Chapter 3: |
Classification of Control Space Parameters for Topological Studies of Reactivity and Chemical Reactions / Chapter 4: |
Understanding and Using the Electron Localization Function (ELF) / Chapter 5: |
Electronic Structure and Reactivity in Double of Rydberg Anions: Characterization of a Novel Kind of Electron Pair / Chapter 6: |