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Understanding Quasi-1d Atomic-Scale Nanowires from AB Initio Theory

atomic-scale array of self-assembled In nanowires that forms the Si(111)-(4x1)In phase at room temperature. More than 10 years ago it;

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Multiscale Modeling

the actual application. The book considers the use of ab initio and density functional theory to obtain parameters needed for larger scale;

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Ab Initio Calculations

their applications in different fields. Ab initio calculations offer results and details that are not obtainable from experimental data and a;

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Computational Modelling of Nanomaterials

book provides an overview of various nanosystems classified by their dimensions: 0D (nanoparticles, QDs, etc.), 1D (nanowires, nanotubes), 2D;

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Ab Initio Molecular Dynamics

Ab initio molecular dynamics revolutionized the field of realistic computer simulation of complex molecular systems and processes;

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Ab Initio Molecular Dynamics

Ab initio molecular dynamics revolutionized the field of realistic computer simulation of complex molecular systems and processes;

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Structure and Dynamics of Atoms and Molecules

trends in atomic and molecular theory. The polarization between ab initio and semi-empirical methods is thoroughly analyzed in two of the;

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Condensed Matter Theories, Volume 20

This volume focuses on the many roles played by ab initio theory, modelling, and high-performance computing in condensed matter and;

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Theory of Atomic Nuclei, Quasi-particle and Phonons

Unique in scope and treatment, Theory of Atomic Nuclei, Quasi-particle and Phonons gives a microscopic description of the structure;

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Theory of Atomic Nuclei, Quasi-particle and Phonons

Unique in scope and treatment, Theory of Atomic Nuclei, Quasi-particle and Phonons gives a microscopic description of the structure;

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The Potential Distribution Theorem and Models of Molecular Solutions

development, as is the testing of those theoretical results with ab initio molecular dynamics simulations. The book is intended for students taking up;

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The Potential Distribution Theorem and Models of Molecular Solutions

development, as is the testing of those theoretical results with ab initio molecular dynamics simulations. The book is intended for students taking up;

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1D and Multi-D Modeling Techniques for IC Engine Simulation

models and coupled 1D-3D modeling techniques, including 0D combustion models, quasi-3D methods, and some 3D model applications.;

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Quantum Mechanical Electronic Structure Calculations with Chemical Accuracy / druk 1

The principal focus of this volume is to illustrate the level of accuracy currently achievable by ab initio quantum chemical calculations;

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Advanced Characterization Techniques For

of the book simulation techniques are presented which are used for ab-initio calculations of relevant semiconductors and for device simulations;

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Electronic Structure Methods for Complex Materials

demonstrates its competitiveness for performing ab initio calculations on large and complex models of practical systems. A brief historical account and;

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Ion-Beam-Based Nanofabrication

1D structures at the few-nanometer scale (e.g., nanowires and quantum dots), and for custom tailoring of nanocomposites, nanoporous materials;

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Modeling Solvent Environments: Applications to Simulations of Biomolecules

advances in applying ab initio methods for modeling solvent properties.;

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IB Diploma

The Panorama hispanohablante suite covers everything you need for the two year ab initio Spanish course for the IB Diploma programme;

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Nanoscale Science and Technology

interdisciplinary view of several aspects of physics at the atomic scale. It contains an overview of the latest findings on the transport of electrons;

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Nanosilicon

due to bright luminescence from porous silicon, nanoparticles and nanowires. New findings from research into metal encapsulated clusters;

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Ab Initio Molecular Orbital Theory

phenomena, this book addresses the formulation of theoretical molecular orbital models starting from quantum mechanics, and compares them to;

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Ab initio Theory of Magnetic Ordering

presents an ab-initio theory to efficiently describe complex magnetic phases and their temperature-dependent properties. The central;

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Ab initio Theory of Magnetic Ordering

presents an ab-initio theory to efficiently describe complex magnetic phases and their temperature-dependent properties. The central;

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Panorama Hispanohablante 2 Coursebook with Cambridge Elevate Edition: Spanish AB Initio for the Ib Diploma

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Theory of Molecular Rydberg States

-authored text to focus on the application of multi-channel quantum defect theory (MQDT) and ab initio theory to this special class of molecular;

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Electron Collision Processes in Atomic and Molecular Physics

. The different topics presented include a wide range from ab-initio methods to complex quantum mechanical calculations apart from experimental;

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