Quantum Frontiers of Atoms and Molecules

by Putz, Mihai V.

• ISBN13: 9781616681586
• ISBN10: 1616681586
• Format: Hardcover
• Copyright: 2011-05-30
• Publisher: Nova Science Pub Inc

Summary

This volume gives larger and deeper coverage of the electronic matters through the physical, chemical and biological ordered systems. With their increasing complexity, the matter structure from the physical to chemical to biological manifestations in an inter-disciplinary cross-fertilisation manner is gradually introduced. The book presents and reviews the avant-garde contributions for the XXI century with equilibrated contents provided by important scientists world-wide demonstrating a valuable impact on quantum fundamentals and applications. In fact, the present volume attempts to serve the unification of the physical-chemical-biological manifestation of atoms in molecules and in nanostructures by means of expanding the quantum frontiers by conjunction, either with relativity, topological information or graph theories as well.

Table of Contents

Foreword

Atoms & Molecules As the Quantum Frontiers of Life

Fulfilling the Dirac Promises on Quantum Chemical Bond

Duality Within the Structure of Complementarity: Right Where It Has No Place to Be

Complementarity Out of Context: Essay on the Rationality of Bohr's Thought

Molecular Integrals Over Slater-Type Orbitals. From Pioneers to Recent Progress

Tunneling Dynamics & Its Signatures In Coupled Systems

Theoretical Calculation of the Low Laying Electronic States of the Molecular Ion Csh+ With Spin-Orbit Effects

Theoretical Explanation of Light Amplifying By Polyethilene Foil

Anharmonic Effects In Normal Mode Vibrations: Their Role In Biological Systems

Emergent Properties In Bohmian Chemistry

The Algebraic Chemistry of Molecules & Reactions

Quantum & Electrodynamic Versatility of Electronegativity & Chemical Hardness

Physics & Chemistry of Carbon In the Light of Shell-Nodal Atomic Model

Molecular Modeling of the Peanut Lectin

Carbohydrate Interaction By Means of the Hybrid Qm/Mm Metho

Electron Density Distributions of Heterocycles: A Shortcoming of the Resonance Model

Electromerism In Small Molecule Activation By Metal Centers of Biological Relevance

Structural Modelling of Nano-Carbons & Composites

Nanostructure Design - Between Science & Art

Quantifying Structural Complexity of Graphs: Information Measures In Mathematical Chemistry

Topological Indices of Nanostructures

On Uniform Representation of Proteins By Distance Matrix

Timisoara Spectral

Structure Activity Relationship

(Spectral-Sar) Algorithm: From Statistical & Algebraic Fundamentals to Quantum Consequences

On Plots In Qsar/Qspr Methodologies

Application of the Fuzzy Logic Theory to Qspr-Qsar Studies

Modeling the Toxicity of Alcohols. Topological Indices Versus Van Der Waals Molecular Descriptors

Index

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