Computer Simulation Of Liquids
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Computer Simulation Of Liquids
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Author : M. P. Allen
language : en
Publisher: Oxford University Press
Release Date : 2017
Computer Simulation Of Liquids written by M. P. Allen and has been published by Oxford University Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2017 with Computers categories.
A first in its field, this book is both an introduction to computer simulation of liquids for upper level undergraduates and a how-to guide for specialists. The authors discuss the latest simulation techniques of molecular dynamics and the Monte Carlo methods as well as how to avoid common programming pitfalls. Theoretical concepts and practical programming advice are amply reinforced with examples of computer simulation in action and samples of Fortran code. The authors have also included a wide selection of programs and routines on microfiche to aid chemists, physicists, chemical engineers, and computer scientists, as well as graduate and advanced students in chemistry.
Computer Simulation Of Liquids
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Author : M. P. Allen
language : en
Publisher: Oxford University Press
Release Date : 1989
Computer Simulation Of Liquids written by M. P. Allen and has been published by Oxford University Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 1989 with Computers categories.
Computer simulation is an essential tool in studying the chemistry and physics of liquids. Simulations allow us to develop models and to test them against experimental data. This book is an introduction and practical guide to the molecular dynamics and Monte Carlo methods.
Computer Simulation Of Liquids
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Author : M. P. Allen
language : en
Publisher:
Release Date : 2002
Computer Simulation Of Liquids written by M. P. Allen and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2002 with Liquids categories.
Computer Simulation Of Liquids
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Author : M. P Allen
language : en
Publisher:
Release Date : 2001
Computer Simulation Of Liquids written by M. P Allen and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2001 with Liquids categories.
Computer Simulation Using Particles
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Author : R.W Hockney
language : en
Publisher: CRC Press
Release Date : 2021-03-24
Computer Simulation Using Particles written by R.W Hockney and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2021-03-24 with Science categories.
Computer simulation of systems has become an important tool in scientific research and engineering design, including the simulation of systems through the motion of their constituent particles. Important examples of this are the motion of stars in galaxies, ions in hot gas plasmas, electrons in semiconductor devices, and atoms in solids and liquids. The behavior of the system is studied by programming into the computer a model of the system and then performing experiments with this model. New scientific insight is obtained by observing such computer experiments, often for controlled conditions that are not accessible in the laboratory. Computer Simulation using Particles deals with the simulation of systems by following the motion of their constituent particles. This book provides an introduction to simulation using particles based on the NGP, CIC, and P3M algorithms and the programming principles that assist with the preparations of large simulation programs based on the OLYMPUS methodology. It also includes case study examples in the fields of astrophysics, plasmas, semiconductors, and ionic solids as well as more detailed mathematical treatment of the models, such as their errors, dispersion, and optimization. This resource will help you understand how engineering design can be assisted by the ability to predict performance using the computer model before embarking on costly and time-consuming manufacture.
Computer Simulations Of Surfaces And Interfaces
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Author : Burkhard Dünweg
language : en
Publisher: Springer Science & Business Media
Release Date : 2003-12-31
Computer Simulations Of Surfaces And Interfaces written by Burkhard Dünweg and has been published by Springer Science & Business Media this book supported file pdf, txt, epub, kindle and other format this book has been release on 2003-12-31 with Computers categories.
Proceedings of the NATO Advanced Study Institute, Albena, Bulgaria, from 9 to 20 September 2002
Simulation Of Liquids And Solids
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Author : Giovanni Ciccotti
language : en
Publisher: North Holland
Release Date : 1987
Simulation Of Liquids And Solids written by Giovanni Ciccotti and has been published by North Holland this book supported file pdf, txt, epub, kindle and other format this book has been release on 1987 with Mathematics categories.
Understanding Molecular Simulation
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Author : Daan Frenkel
language : en
Publisher: Elsevier
Release Date : 2001-10-19
Understanding Molecular Simulation written by Daan Frenkel and has been published by Elsevier this book supported file pdf, txt, epub, kindle and other format this book has been release on 2001-10-19 with Science categories.
Understanding Molecular Simulation: From Algorithms to Applications explains the physics behind the "recipes" of molecular simulation for materials science. Computer simulators are continuously confronted with questions concerning the choice of a particular technique for a given application. A wide variety of tools exist, so the choice of technique requires a good understanding of the basic principles. More importantly, such understanding may greatly improve the efficiency of a simulation program. The implementation of simulation methods is illustrated in pseudocodes and their practical use in the case studies used in the text. Since the first edition only five years ago, the simulation world has changed significantly -- current techniques have matured and new ones have appeared. This new edition deals with these new developments; in particular, there are sections on: · Transition path sampling and diffusive barrier crossing to simulaterare events · Dissipative particle dynamic as a course-grained simulation technique · Novel schemes to compute the long-ranged forces · Hamiltonian and non-Hamiltonian dynamics in the context constant-temperature and constant-pressure molecular dynamics simulations · Multiple-time step algorithms as an alternative for constraints · Defects in solids · The pruned-enriched Rosenbluth sampling, recoil-growth, and concerted rotations for complex molecules · Parallel tempering for glassy Hamiltonians Examples are included that highlight current applications and the codes of case studies are available on the World Wide Web. Several new examples have been added since the first edition to illustrate recent applications. Questions are included in this new edition. No prior knowledge of computer simulation is assumed.
Statistical Mechanics Of Nonequilibrium Liquids
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Author : Denis J. Evans
language : en
Publisher: ANU E Press
Release Date : 2007-08-01
Statistical Mechanics Of Nonequilibrium Liquids written by Denis J. Evans and has been published by ANU E Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2007-08-01 with Science categories.
"There is a symbiotic relationship between theoretical nonequilibrium statistical mechanics on the one hand and the theory and practice of computer simulation on the other. Sometimes, the initiative for progress has been with the pragmatic requirements of computer simulation and at other times, the initiative has been with the fundamental theory of nonequilibrium processes. This book summarises progress in this field up to 1990"--Publisher's description.
An Introduction To Computer Simulation Methods
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Author : Harvey Gould
language : en
Publisher: Addison Wesley Publishing Company
Release Date : 1988
An Introduction To Computer Simulation Methods written by Harvey Gould and has been published by Addison Wesley Publishing Company this book supported file pdf, txt, epub, kindle and other format this book has been release on 1988 with BASIC (Computer program language). categories.