Modelling transport and mixing by turbulence in complex flows is one of the greatest challenges for CFD. This highly readable volume introduces the reader to a level of modelling that respects the complexity of the physics of turbulent flows – second-moment closure. Following introductory chapters providing essential physical background, the book examines in detail the processes to be modelled, from fluctuating pressure interactions to diffusive transport, from turbulent time and length sc...

Essentials of Computational Chemistry provides a balanced introduction to this dynamic subject. Suitable for both experimentalists and theorists, a wide range of samples and applications are included drawn from all key areas. The book carefully leads the reader thorough the necessary equations providing information explanations and reasoning where necessary and firmly placing each equation in context.

Eagerly awaited, this second edition of a best-selling text comprehensively describes from a modern perspective the basics of x-ray physics as well as the completely new opportunities offered by synchrotron radiation. Written by internationally acclaimed authors, the style of the book is to develop the basic physical principles without obscuring them with excessive mathematics.The second edition differs substantially from the first edition, with over 30% new material, incl...

Building up gradually from first principles, this unique introduction to modern thermodynamics integrates classical, statistical and molecular approaches and is especially designed to support students studying chemical and biochemical engineering. In addition to covering traditional problems in engineering thermodynamics in the context of biology and materials chemistry, students are also introduced to the thermodynamics of DNA, proteins, polymers and surfaces. It includes over 80 detailed...

Aimed at students and researchers entering the field, this pedagogical introduction to numerical relativity will also interest scientists seeking a broad survey of its challenges and achievements. Assuming only a basic knowledge of classical general relativity, the book develops the mathematical formalism from first principles, and then highlights some of the pioneering simulations involving black holes and neutron stars, gravitational collapse and gravitational waves. The book contains 30...

Determining the structure of molecules is a fundamental skill that all chemists must learn. Structural Methods in Molecular Inorganic Chemistry is designed to help readers interpret experimental data, understand the material published in modern journals of inorganic chemistry, and make decisions about what techniques will be the most useful in solving particular structural problems.Following a general introduction to the tools and concepts in structural chemistry, the foll...

Computational Materials Science provides the theoretical basis necessary for understanding atomic surface phenomena and processes of phase transitions, especially crystallization, is given. The most important information concerning computer simulation by different methods and simulation techniques for modeling of physical systems is also presented. A number of results are discussed regarding modern studies of surface processes during crystallization. There is sufficiently full information ...

Describing the physical properties of quantum materials near critical points with long-range many-body quantum entanglement, this book introduces readers to the basic theory of quantum phases, their phase transitions and their observable properties. This second edition begins with a new section suitable for an introductory course on quantum phase transitions, assuming no prior knowledge of quantum field theory. It also contains several new chapters to cover important recent advances, such ...

This new text surveys a series of fundamental problems in astrophysics, both analytically and computationally, for advanced students in physics and astrophysics. The contents are supported by more than 110 class-tested Mathematica® notebooks, allowing rigorous solutions to be explored in a visually engaging way. Topics covered include many classical and historically interesting problems, enabling students to appreciate the mathematical and scientific challenges that have been overcome in t...

Providing an up-to-date and lucid presentation of phenomena across modern advanced-level solid state physics, this new edition builds on an elementary understanding to introduce students to the key research topics with the minimum of mathematics. It covers cutting-edge topics, including electron transport and magnetism in solids. It is the first book to explain topological insulators and strongly correlated electrons. Explaining solid state physics in a clear and detailed way, it also has ...

A concise, basic introduction to modelling and computational chemistry which focuses on the essentials, including MM, MC, and MD, along with a chapter devoted to QSAR and Discovery Chemistry.Includes supporting website featuring background information, full colour illustrations, questions and answers tied into the text,Visual Basic packages and many realistic examples with solutionsTakes a hands-on approach, using state of the art software packages ...

Taking the reader through the underlying principles of molecular translational dynamics, this book outlines the ways in which magnetic resonance, through the use of magnetic field gradients, can reveal those dynamics. The measurement of diffusion and flow, over different length and time scales, provides unique insight regarding fluid interactions with porous materials, as well as molecular organisation in soft matter and complex fluids. The book covers both time and frequency domain method...