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Combining Quantum Mechanics and Molecular Mechanics. Some Recent Progresses in QM/MM Methods

international researchers in quantum and theoretical chemistry Highlights important interdisciplinary developments;

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Computational Organometallic Chemistry

classical and molecular mechanics (MM), quantum mechanics (QM), and hybrid MMQM techniques. It demonstrates applications in actinide chemistry;

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Computational Organometallic Chemistry

classical and molecular mechanics (MM), quantum mechanics (QM), and hybrid MMQM techniques. It demonstrates applications in actinide chemistry;

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Elementary Molecular Quantum Mechanics

way, and McWeeny's Methods of Molecular Quantum Mechanics, where recent advances in the application of quantum mechanical methods to molecular;

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QM/MM Studies of Light-responsive Biological Systems

is challenging to both theoretical and experimental studies. This volume encompasses the quantum mechanicsmolecular mechanics theory in several;

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QM MM Studies of Light responsive Biological Systems

is challenging to both theoretical and experimental studies. This volume encompasses the quantum mechanicsmolecular mechanics theory in several;

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Methods of Molecular Quantum Mechanics

in molecular quantum mechanics. It contains a consistent use of atomic units from the very beginning for simplifying mathematical formulae, and;

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Methods of Molecular Quantum Mechanics

in molecular quantum mechanics. It contains a consistent use of atomic units from the very beginning for simplifying mathematical formulae, and;

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Quantum Chemistry

mechanics, atomic structure, and molecular electronics, and clearly demonstrates the usefulness and limitations of current quantum-mechanical;

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Quantum Mechanics

Although there are many textbooks that deal with the formal apparatus of quantum mechanics (QM) and its application to standard problems;

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Essential Quantum Mechanics for Electrical Engineers

Quantum mechanics (QM) is latently present in the life of electrical engineers already, since the hardware of todays information technology;

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Basic Molecular Quantum Mechanics

of science and technology. Basic Molecular Quantum Mechanics introduces quantum mechanics by covering the fundamentals of quantum mechanics and;

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Basic Molecular Quantum Mechanics

of science and technology. Basic Molecular Quantum Mechanics introduces quantum mechanics by covering the fundamentals of quantum mechanics and;

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Computational Methods to Study the Structure and Dynamics of Biomolecules and Bi

of biomolecules and biomolecular processes. It is organized in four main parts; the first one deals with methodology of molecular simulations; the second;

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Introduction to Quantum Mechanics

including molecular spectroscopy, lasers and NMR. Blinder also discusses recent conceptual developments in quantum theory, including;

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World According To Quantum Mechanics, The

'The authors should be recognised for their efforts to present a mathematically rigorous introduction to Quantum Mechanics (QM) in a form;

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Introduction to Quantum Mechanics

underpinning quantum mechanics in Part 1, the book goes on to expand upon these in Part 2, where fundamental concepts such as molecular structure and;

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Principles Of Molecular Mechanics

Principles of Molecular Mechanics Katsunosuke Machida Computational methods in chemistry have become increasingly important over recent;

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Molecular Quantum Mechanics

latest advances in computational techniques, and enhanced with more mathematical support and worked examples than ever before,Molecular Quantum;

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Quantum Mechanics

Although there are many textbooks that deal with the formal apparatus of quantum mechanics (QM) and its application to standard problems;

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Molecular Simulations Fundamentals &

statistical and quantum mechanics. In addition to Monte-Carlo methods, which are based on random sampling, the core of the book covers molecular;

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Molecular Quantum Mechanics

Molecular Quantum Mechanics 5e editie is een boek van Peter W. Atkins uitgegeven bij Oxford University Press. ISBN 9780199541423

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Frontier Problems In Quantum Mechanics

boundary between quantum and classical mechanics, quantum mechanics on the macroscopic level, and so on. Part of this book is devoted to;

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Computational Mechanics Research Trends

incorporation of quantum, molecular and biological mechanics into new models, CM is poised to play an even bigger role in the future. This new and;

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Recent Developments in Quantum Mechanics

Reviews the current status of several mathematical problems in quantum mechanics, focusing on the behavior of Bloch electrons in electric;

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Reviews in Computational Chemistry

on topics centered on molecular modeling, such as computer-assisted molecular design (CAMD), quantum chemistry, molecular mechanics and;

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The Semiclassical Way to Dynamics and Spectroscopy

various kinds of spectroscopy, such as molecular spectroscopy and electron imaging and quantum dynamical systems with an emphasis on tunneling;

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