Search Results for "computer-simulation-of-liquids"

Computer Simulation of Liquids

Computer Simulation of Liquids

  • Author: M. P. Allen,D. J. Tildesley
  • Publisher: Oxford University Press
  • ISBN: 9780198556459
  • Category: History
  • Page: 385
  • View: 3856
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This book describes how to use computers to simulate the properties of liquids. It provides an introduction and practical guide to the molecular dynamics and Monte Carlo methods. 'The book is comprehensive, thorough and readable' Chemistry in Britain

Computer Simulation of Liquids

Computer Simulation of Liquids

Second Edition

  • Author: Michael P. Allen,Dominic J. Tildesley
  • Publisher: Oxford University Press
  • ISBN: 0192524704
  • Category: Science
  • Page: 640
  • View: 9565
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This book provides a practical guide to molecular dynamics and Monte Carlo simulation techniques used in the modelling of simple and complex liquids. Computer simulation is an essential tool in studying the chemistry and physics of condensed matter, complementing and reinforcing both experiment and theory. Simulations provide detailed information about structure and dynamics, essential to understand the many fluid systems that play a key role in our daily lives: polymers, gels, colloidal suspensions, liquid crystals, biological membranes, and glasses. The second edition of this pioneering book aims to explain how simulation programs work, how to use them, and how to interpret the results, with examples of the latest research in this rapidly evolving field. Accompanying programs in Fortran and Python provide practical, hands-on, illustrations of the ideas in the text.

Computer simulation of liquids

Computer simulation of liquids

  • Author: Robert Hill Kincaid
  • Publisher: N.A
  • ISBN: N.A
  • Category: Liquid ammonia
  • Page: 282
  • View: 3527
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Simulation of liquids and solids

Simulation of liquids and solids

molecular dynamics and Monte Carlo methods in statistical mechanics

  • Author: Giovanni Ciccotti,Daan Frenkel,Ian Ranald McDonald
  • Publisher: North Holland
  • ISBN: N.A
  • Category: Mathematics
  • Page: 481
  • View: 615
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Computer Simulations of Liquid Crystals and Polymers

Computer Simulations of Liquid Crystals and Polymers

Proceedings of the NATO Advanced Research Workshop on Computational Methods for Polymers and Liquid Crystalline Polymers, Erice, Italy. 16-22 July 2003

  • Author: Paolo Pasini,Claudio Zannoni,Slobodan Žumer
  • Publisher: Springer Science & Business Media
  • ISBN: 1402027605
  • Category: Science
  • Page: 364
  • View: 5837
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Liquid crystals, polymers and polymer liquid crystals are soft condensed matter systems of major technological and scientific interest. An understanding of the macroscopic properties of these complex systems and of their many and interesting peculiarities at the molecular level can nowadays only be attained using computer simulations and statistical mechanical theories. Both in the Liquid Crystal and Polymer fields a considerable amount of simulation work has been done in the last few years with various classes of models at different special resolutions, ranging from atomistic to molecular and coarse-grained lattice models. Each of the two fields has developed its own set of tools and specialized procedures and the book aims to provide a state of the art review of the computer simulation studies of polymers and liquid crystals. This is of great importance in view of a potential cross-fertilization between these connected areas which is particularly apparent for a number of experimental systems like, e.g. polymer liquid crystals and anisotropic gels where the different fields necessarily merge. An effort has been made to assess the possibilities of a coherent description of the themes that have developed independently, and to compare and extend the theoretical and computational techniques put forward in the different areas.

Novel Approaches to the Structure and Dynamics of Liquids: Experiments, Theories and Simulations

Novel Approaches to the Structure and Dynamics of Liquids: Experiments, Theories and Simulations

  • Author: Jannis Samios,Vladimir A. Durov
  • Publisher: Springer Science & Business Media
  • ISBN: 9781402018473
  • Category: Science
  • Page: 547
  • View: 1421
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Proceedings of the NATO Advanced Study Institute, Rhodes, Greece from 6 to 15 September 2002

Predictive Simulation of Semiconductor Processing

Predictive Simulation of Semiconductor Processing

Status and Challenges

  • Author: Jaroslaw Dabrowski,Eicke R. Weber
  • Publisher: Springer Science & Business Media
  • ISBN: 9783540204817
  • Category: Technology & Engineering
  • Page: 490
  • View: 7679
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Predictive Simulation of Semiconductor Processing enables researchers and developers to extend the scaling range of semiconductor devices beyond the parameter range of empirical research. It requires a thorough understanding of the basic mechanisms employed in device fabrication, such as diffusion, ion implantation, epitaxy, defect formation and annealing, and contamination. This book presents an in-depth discussion of our current understanding of key processes and identifies areas that require further work in order to achieve the goal of a comprehensive, predictive process simulation tool.

Physical Properties of Liquid Crystals

Physical Properties of Liquid Crystals

  • Author: George W. Gray,Volkmar Vill,Hans W. Spiess,Dietrich Demus,John W. Goodby
  • Publisher: John Wiley & Sons
  • ISBN: 3527613951
  • Category: Technology & Engineering
  • Page: 522
  • View: 1208
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This handbook is a unique compendium of knowledge on all aspects of the physics of liquid crystals. In over 500 pages it provides detailed information on the physical properties of liquid crystals as well as the recent theories and results on phase transitions, defects and textures of different types of liquid crystals. An in-depth understanding of the physical fundamentals is a prerequisite for everyone working in the field of liquid crystal research. With this book the experts as well as graduate students entering the field get all the information they need.

Simulation of Sheared Suspensions With a Parallel Implementation of QDPD

Simulation of Sheared Suspensions With a Parallel Implementation of QDPD

  • Author: N.A
  • Publisher: DIANE Publishing
  • ISBN: 9781422318447
  • Category:
  • Page: N.A
  • View: 3197
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Statistical Mechanics of Nonequilibrium Liquids

Statistical Mechanics of Nonequilibrium Liquids

  • Author: Denis J. Evans,Gary P. Morriss
  • Publisher: Elsevier
  • ISBN: 1483260453
  • Category: Science
  • Page: 316
  • View: 901
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Statistical Mechanics of Nonequilibrium Liquids deals with theoretical rheology. The book discusses nonlinear response of systems and outlines the statistical mechanical theory. In discussing the framework of nonequilibrium statistical mechanics, the book explains the derivation of a nonequilibrium analogue of the Gibbsian basis for equilibrium statistical mechanics. The book reviews the linear irreversible thermodynamics, the Liouville equation, and the Irving-Kirkwood procedure. The text then explains the Green-Kubo relations used in linear transport coefficients, the linear response theory, the isothermal linear response theory, as well as the equivalence of thermostatted linear responses. The book also describes how thermostatted linear mechanical response of many-body systems can be related to equilibrium fluctuations. The text explains the procedure for calculating the linear Navier-Stokes transport coefficients through computer simulation algorithms. The book also discusses the van Kampen objection to linear response theory, the steady-state fluctuations, and the thermodynamics of steady states. The text will prove valuable for researchers in molecular chemistry, scientists, and academicians involved in advanced physics.