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Electronic And Nuclear Dynamics In Molecular Systems

nuclear and electronic motions in molecular systems are described. It is suitable for researchers who want to make an active contribution to the;

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Electron Dynamics In Molecular Interactions

This volume provides a comprehensive introduction to the theory of electronic motion in molecular processes - an increasingly relevant and;

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Analysis and Control of Ultrafast Photoinduced Reactions

emphasizes the analysis and characterization of the nuclear dynamics within molecular systems in various environments induced by optical excitations;

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Ab Initio Molecular Dynamics

, including chemical reactions, by unifying molecular dynamics and electronic structure theory. This book provides the first coherent presentation;

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Ab Initio Molecular Dynamics

, including chemical reactions, by unifying molecular dynamics and electronic structure theory. This book provides the first coherent presentation;

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Quantum Effects in Small Molecular Systems

in isolation, and interact with their environments, in ways that are not yet fully understood. The coupled electronic and nuclear motions may lead to;

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Molecular Simulation in Material & Biological Research

This important book focuses on the different aspects of molecular simulation in material and biological research, on the computational and;

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Condensed Matter Theories

effect of relativity in nuclear structure, molecular dynamics and phase transitions in solids, nuclei and quarks and QCD dynamics for hadrons and;

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Theoretical Chemistry for Electronic Excited States

theorists and experimentalists, involved in theoretical chemistry, in electronic structure computations and in molecular dynamics. The book will;

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Electronic, Atomic and Molecular Calculations

Molecular Calculations is designed to assist scientists applying GCM in the analysis of the electronic structure of atoms and molecules. There have;

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Modelling Molecular Structure and Reactivity in Biological Systems

Computational and theoretical tools for understanding biological processes at the molecular level is an exciting and innovative area;

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Computer Simulations Of Molecules And Condensed Matter

more. Molecular dynamics simulations are also discussed, with extensions to enhanced sampling and free-energy calculation techniques including;

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Concepts and Methods in Modern Theoretical Chemistry

learn how concepts from ab initio quantum chemistry, density functional theory (DFT), and molecular simulation can be used to describe;

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Computational Materials & Biological Sciences

the studying of nanoscale phenomena in the materials and life sciences. This book discusses modern molecular simulation methods for the study;

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Advances and Applied Principles of Molecular Dynamics

This book elucidates the ever-growing applications of molecular dynamics simulations to overcome a broad spectrum of scientific and;

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Quantum Chemistry and Dynamics of Excited States

An introduction to the rapidly evolving methodology of electronic excited states For academic researchers, postdocs, graduate and;

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Heat Transfer Physics

and fluid-state physics, and quantum optics. The textbook presents a unified theory, over fine-structuremolecular-dynamics/Boltzmann;

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Latest Advances In Atomic Cluster Collisions

properties of nuclear, atomic, molecular, biological and complex cluster systems studied by means of photonic, electronic, heavy particle and atomic;

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Information Theory of Molecular Systems

" (similarity) and independence. Information Theory of Molecular Systems applies standard IT to classical problems in the theory of electronic;

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Biomolecular Simulations

modelling of biological systems, including methods for electronic structure calculations, classical molecular dynamics simulations and coarse;

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Advances in the Theory of Atomic and Molecular Systems

Advances in the Theory of Atomic and Molecular Systems, is a collection of contributions presenting recent theoretical and computational;

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Understanding Spin Dynamics

Experimental methods employing spin resonance effects (nuclear magnetic resonance and electron spin resonance) are broadly used;

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Encyclopedia of Molecular Dynamics

compilation of the productive functions of molecular dynamics simulations to resolve a broad variety of technical and production complications. The;

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Emergent Complexity from Nonlinearity, in Physics, Engineering and the Life Sciences

-linearity in electronic circuits to synchronisation effects in complex networks to biological systems, neural dynamics and the complex organisation;

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Advances On Nonlinear Dynamics Of Electronic Systems

This book comprises the most recent advanced results on nonlinear electronic circuits, and the contents range from networks;

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Reviews in Computational Chemistry, Volume 2

, electrostatic potentials, electronic spectroscopy, molecular property correlations, and the computational chemistry literature. Methodologies described;

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