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Computer Simulation Studies in Condensed Matter Physics III: Proceedings of the Third Workshop Athens, GA, USA, February 12–16, 1990 (Springer Proceedings in Physics #53)
by David P. Landau K. K. Mon Heinz-Bernd SchüttlerThe contribution of computer simulation studies to our understanding of the prop erties of a wide range of condensed matter systems is now weIl established. The Center for Simulational Physics of the University of Georgia has been hosting a series of annual workshops with the intent of bringing together experienced prac titioners in the field, as weIl as relative newcomers, to provide a forum for the exchange of ideas and recent results. This year's workshop, the third in the series, was held February 12-16, 1990. These proceedings are arecord of the workshop and are published with the goal of timely dissemination of the papers to a wider audience. The proceedings are divided into four parts. The first contains invited pa pers dealing with simulational studies of classical systems and also includes an introduction to some new simulation techniques. Aseparate section is devoted to invited papers on quantum systems, including new results for strongly correlated electron and quantum spin models believed to be important for the description of high-Tc superconductors. The third part consists of a single invited paper, which presents a comprehensive treatment of issues associated with high perfor mance computing, including differences in architectures and a discussion of access strategies. The contributed papers constitute the final part.
Computer Simulation Studies in Condensed-Matter Physics IV: Proceedings of the Fourth Workshop, Athens, GA, USA, February 18–22, 1991 (Springer Proceedings in Physics #72)
by David P. Landau K. K. Mon Heinz-Bernd SchüttlerThe contribution of computer simulation studies to our understanding of proper ties of a wide range of condensed-matter systems is now well established. The Center for Simulational Physics has been hosting annual workshops with the in tent of bringing together some of the experienced practitioners in the field, as well as relative newcomers in the field, to provide a forum for the exchange of ideas and recent results. This year's workshop, the fourth in the series, was held at the University of Georgia, February 18-22, 1991. These proceedings are a record of the workshop and are published with the goal of timely dissemination of the papers to a wider audience. The proceedings are divided into three parts. The first part contains invited papers which deal with simulational studies of classical systems and includes an introduction to some new simulation techniques and special purpose comput ers as well. A separate section of the proceedings is devoted to invited papers on quantum systems including new results for strongly correlated electron and quantum spin models believed to be important for the description of high-T c superconductors. The contributed presentations comprise the final chapter.
Computer Simulation Studies in Condensed-Matter Physics IX: Proceedings of the Ninth Workshop Athens, GA, USA, March 4–9, 1996 (Springer Proceedings in Physics #82)
by David P. Landau Kin-Keung Mon Heinz-Bernd SchüttlerComputer Simulation Studies in Condensed-Matter Physics IX covers recent developments in this field. This workshop was the ninth in this series and was held at the University of Georgia, March 4-9, 1996, and these proceedings form a record which is published with the goal of timely dissemination of the material to a wider audience. This volume is composed of three parts. The first section contains invited papers that deal with simulational studies of classical systems. The second section of the proceedings is devoted to invited papers on quantum systems, including new results for strongly correlated electron and quantum spin models. The final section comprises contributed presentations.
Computer Simulation Studies in Condensed-Matter Physics V: Proceedings of the Fifth Workshop Athens, GA, USA, February 17–21, 1992 (Springer Proceedings in Physics #75)
by David P. Landau K. K. Mon Heinz-Bernd SchüttlerAs the role of computer simulations began to increase in importance, we sensed a need for a "meeting place" for both experienced simulators and neophytes to discuss new techniques and results in an evironment which promotes extended discussion. As a consequence of these concerns, The Center for Simulational Physics established an annual workshop on Recent Developments in Computer Simulation Studies in Condensed-Matter Physics. This year's workshop was the fifth in this series and the interest which the scientific community has shown demonstrates quite clearly the useful purpose which the series has served. The workshop was held at the University of Georgia, February 17-21, 1992, and these proceedings form a record of the workshop which is published with the goal of timely dissemination of the papers to a wider audience. The proceedings are divided into four parts. The first part contains invited papers which deal with simulational studies of classical systems and includes an introduction to some new simulation techniques and special purpose computers as well. A separate section of the proceedings is devoted to invited papers on quantum systems including new results for strongly correlated electron and quan tum spin models. The third section is comprised of a single, invited description of a newly developed software shell designed for running parallel programs. The contributed presentations comprise the final chapter.
Computer Simulation Studies in Condensed-Matter Physics VI: Proceedings of the Sixth Workshop, Athens, GA, USA, February 22–26, 1993 (Springer Proceedings in Physics #76)
by David P. Landau K. K. Mon Heinz-Bernd SchüttlerComputer Simulation Studies in Condensed-Matter Physics VI provides a broad overview of recent developments in this field. Based on the last workshop, it presents invited and contributed papers which describe new physical results, simulational techniques and ways of interpreting simulational data. Both classical and quantum systems are discussed.
Computer Simulation Studies in Condensed-Matter Physics VII: Proceedings of the Seventh Workshop Athens, GA, USA, 28 February – 4 March 1994 (Springer Proceedings in Physics #78)
by David P. Landau K. K. Mon Heinz-Bernd SchüttlerComputer Simulation Studies in Condensed-Matter Physics VII provides a broad overview of recent developments. Presented at the recent workshop, it contains the invited and contributed papers which describe new physical results, simulational techniques and ways of interpreting simulational data. Both classical and quantum systems are discussed.
Computer Simulation Studies in Condensed-Matter Physics VIII: Recent Developments Proceedings of the Eighth Workshop Athens, GA, USA, February 20–24, 1995 (Springer Proceedings in Physics #80)
by David P. Landau Kin-Keung Mon Heinz-Bernd SchüttlerComputer Simulation Studies in Condensed-Matter Physics VIII covers recent developments in this field presented at the 1995 workshop, such as new algorithms, methods of analysis, and conceptual developments. This volume is composed of three parts. The first part contains invited papers that deal with simulational studies of classical systems. The second part is devoted to invited papers on quantum systems, including new results for strongly correlated electron and quantum spin models. The final part comprises contributed presentations.
Computer Simulation Studies in Condensed-Matter Physics X: Proceedings of the Tenth Workshop Athens, GA, USA, February 24–28, 1997 (Springer Proceedings in Physics #83)
by David P. Landau Kin-Keung Mon Heinz-Bernd SchüttlerComputer Simulation Studies in Condensed-Matter Physics X is devoted to Prof. Masuo Suzuki's ideas, which have made novel, new simulations possible. These proceedings, of the 1997 workshop, comprise three parts that deal with new algorithms, methods of analysis, and conceptual developments. The first part contains invited papers that deal with simulational studies of classical systems. The second of the proceedings is devoted to invited papers on quantum systems, including new results for strongly correlated electron and quantum spin models. The final part contains a large number of contributed presentations.
Computer Simulation Studies in Condensed-Matter Physics XI: Proceedings of the Eleventh Workshop Athens, GA, USA, February 22–27, 1998 (Springer Proceedings in Physics #84)
by David P. Landau Heinz-Bernd SchüttlerMore than a decade ago, because of the phenomenal growth in the power of computer simulations, The University of Georgia formed the first institutional unit devoted to the use of simulations in research and teaching: The Center for Simulational Physics. As the simulations community expanded further, we sensed a need for a meeting place for both experienced simulators and neophytes to discuss new techniques and recent results in an environment which promoted extended discussion. As a consequence, the Center for Simulational Physics established an annual workshop on Recent Developments in Computer Simulation Studies in Condensed Matter Physics. This year's workshop was the eleventh in this series, and the interest shown by the scientific community demonstrates quite clearly the useful purpose which the series has served. The latest workshop was held at The University of Georgia, February 23-27, 1998, and these proceedings provide a "status report" on a number of important topics. This volume is published with the goal of timely dissemination of the material to a wider audience. We wish to offer a special thanks to IBM Corporation for their generous support of this year's workshop. This volume contains both invited papers and contributed presentations on problems in both classical and quantum condensed matter physics. We hope that each reader will benefit from specialized results as well as profit from exposure to new algorithms, methods of analysis, and conceptual developments. Athens, GA, U. S. A. D. P. Landau April 1998 H-B.
Computer Simulation Studies in Condensed-Matter Physics XII: Proceedings of the Twelfth Workshop, Athens, GA, USA, March 8-12, 1999 (Springer Proceedings in Physics #85)
by D. P. Landau S. P. Lewis H. B. SchüttlerMore than a decade ago, because of the phenomenal growth in the power of computer simulations, The University of Georgia formed the first institutional unit devoted to the use of simulations in research and teaching: The Center for Simulational Physics. As the simulations community expanded further, we sensed a need for a meeting place for both experienced simulators and neophytes to discuss new techniques and recent results in an environment which promoted extended discussion. As a consequence, the Center for Sim ulational Physics established an annual workshop on Recent Developments in Computer Simulation Studies in Condensed Matter Physics. This year's workshop was the twelfth in this series. It was held at The University of Geor gia, March 8-12, 1999 as an unofficial satellite conference to the Centennial Meeting of the American Physical Society in Atlanta, GA. The continued interest shown by the scientific community demonstrates quite clearly the useful purpose which the series has served. These proceedings provide a "sta tus report" on a number of important topics. This volume is published with the goal of timely dissemination of the material to a wider audience. We wish to offer special thanks to IBM Corporation for their generous support of this year's workshop. This volume contains both invited papers and contributed presentations on problems in both classical and quantum condensed matter physics. We hope that each reader will benefit from specialized results as well as profit from exposure to new algorithms, methods of analysis, and conceptual devel opments.
Computer Simulation Studies in Condensed-Matter Physics XIII: Proceedings of the Thirteenth Workshop, Athens, GA, USA, February 21–25, 2000 (Springer Proceedings in Physics #86)
by D. P. Landau S. P. Lewis H. B. SchüttlerAlmost fifteen years ago, because of the phenomenal growth in the power of computer simulations, The University of Georgia formed the first institu tional unit devoted to the use of simulations in research and teaching: The Center for Simulational Physics. As the international simulations community expanded further, we sensed a need for a meeting place for both experi enced simulators and neophytes to discuss new techniques and recent results in an environment which promoted extended discussion. As a consequence, the Center for Simulational Physics established an annual workshop on Re cent Developments in Computer Simulation Studies in Condensed Matter Physics. This year's workshop was the thirteenth in this series, and the con tinued interest shown by the scientific community demonstrates quite clearly the useful purpose that these meetings have served. The latest workshop was held at The University of Georgia, February 21-25, 2000, and these proceed ings provide a "status report" on a number of important topics. This volume is published with the goal of timely dissemination of the material to a wider audience. We wish to offer a special thanks to the IBM Corporation for its generous support of this year's workshop. We also acknowledge the Donors of the Petroleum Research Fund, administered by the American Chemical Society, and the National Science Foundation for partial support. This volume contains both invited papers and contributed presentations on problems in both classical and quantum condensed matter physics.
Computer Simulation Studies in Condensed-Matter Physics XIV: Proceedings of the Fourteenth Workshop, Athens, GA, USA, February 19–24, 2001 (Springer Proceedings in Physics #89)
by D. P. Landau S. P. Lewis H. B. SchüttlerOver the last 30 years, Professor David P. Landau's trailblazing research achievements and influential leadership have helped establish computer sim ulation as a powerful and incisive mode of scientific investigation, now on a par in the physical sciences with experimental and theoretical research. This year, we were very pleased to organize a special one-day symposium honor ing the 60th birthday of our distinguished colleague and friend. This event was held in conjunction with and immediately following the annual computer simulations workshop that Professor Landau founded 14 years ago. Many of the papers presented at this honorary symposium are integrated into this pro ceedings volume, and the accompanying photograph of participants serves to commemorate this very special event. This volume contains both invited papers and contributed presentations on problems in both classical and quantum condensed matter physics. We hope that each reader will benefit from specialized results as well as profit from exposure to new algorithms, methods of analysis, and conceptual devel opments.
Computer Simulation Studies in Condensed-Matter Physics XIX: Proceedings of the Nineteenth Workshop Athens, GA, USA, February 20--24, 2006 (Springer Proceedings in Physics #123)
by David P. Landau Steven P. Lewis Heinz-Bernd SchüttlerThis status report features the most recent developments in the field, spanning a wide range of topical areas in the computer simulation of condensed matter/materials physics. Both established and new topics are included, ranging from the statistical mechanics of classical magnetic spin models to electronic structure calculations, quantum simulations, and simulations of soft condensed matter.
Computer Simulation Studies in Condensed-Matter Physics XV: Proceedings of the Fifteenth Workshop Athens, GA, USA, March 11–15, 2002 (Springer Proceedings in Physics #90)
by David P. Landau Steven P. Lewis Heinz-Bernd SchüttlerOver fifteen years ago, because of the tremendous increase in the power and utility of computer simulations, The University of Georgia formed the first institutional unit devoted to the use of simulations in research and teach ing: The Center for Simulational Physics. As the international simulations community expanded further, we sensed a need for a meeting place for both experienced simulators and neophytes to discuss new techniques and recent results in an environment which promoted lively discussion. As a consequence, the Center for Simulational Physics established an annual workshop on Re cent Developments in Computer Simulation Studies in Condensed Matter Physics. This year's workshop was the fifteenth in this series, and the con tinued interest shown by the scientific community demonstrates quite clearly the useful purpose that these meetings have served. The latest workshop was held at The University of Georgia, March 11-15, 2002, and these proceedings provide a "status report" on a number of important topics. This volume is published with the goal of timely dissemination of the material to a wider audience. We wish to offer a special thanks to IBM Corporation and to the National Science Foundation for partial support of this year's workshop. This volume contains both invited papers and contributed presentations on problems in both classical and quantum condensed matter physics. We hope that each reader will benefit from specialized results as well as profit from exposure to new algorithms, methods of analysis, and conceptual devel opments. Athens, GA, USA D. P.
Computer Simulation Studies in Condensed-Matter Physics XVI: Proceedings of the Fifteenth Workshop, Athens, GA, USA, February 24–28, 2003 (Springer Proceedings in Physics #95)
by David P. Landau Steven P. Lewis Heinz-Bernd SchüttlerThis status report features the most recent developments in the field, spanning a wide range of topical areas in the computer simulation of condensed matter/materials physics. Highlights of this volume include various aspects of non-equilibrium statistical mechanics, studies of properties of real materials using both classical model simulations and electronic structure calculations, and the use of computer simulation in teaching.
Computer Simulation Studies in Condensed-Matter Physics XVII: Proceedings of the Seventeenth Workshop, Athens, GA, USA, February 16-20, 2004 (Springer Proceedings in Physics #103)
by David P. Landau Steven P. Lewis Heinz-Bernd SchüttlerOver ?fteen years ago, because of the tremendous increase in the power and utility of computer simulations, The University of Georgia formed the ?rst institutional unit devoted to the use of simulations in research and teaching: The Center for Simulational Physics. As the international simulations c- munityexpandedfurther,wesensedaneedforameetingplaceforbothex- riencedsimulatorsandneophytestodiscussnewtechniquesandrecentresults in an environment which promoted lively discussion. As a consequence, the Center for Simulational Physics established an annual workshop on Recent DevelopmentsinComputerSimulationStudiesinCondensedMatterPhysics. This year’s workshop was the seventeenth in this series, and the continued interest shown by the scienti?c community demonstrates quite clearly the useful purpose that these meetings have served. The latest workshop was held at The University of Georgia, February 16–20, 2004, and these proce- ings provide a “status report” on a number of important topics. This volume is published with the goal of timely dissemination of the material to a wider audience. We wish to o?er a special thanks to IBM and to SGI for partial support of this year’s workshop. This volume contains both invited papers and contributed presentations on problems in both classical and quantum condensed matter physics. We hope that each reader will bene?t from specialized results as well as pro?t from exposure to new algorithms, methods of analysis, and conceptual dev- opments.
Computer Simulation Studies in Condensed-Matter Physics XVIII: Proceedings of the Eighteenth Workshop, Athens, GA, USA, March 7-11, 2005 (Springer Proceedings in Physics #105)
by David P. Landau Steven P. Lewis Heinz-Bernd SchüttlerThis status report features the most recent developments in the field, spanning a wide range of topical areas in the computer simulation of condensed matter/materials physics. Both established and new topics are included, ranging from the statistical mechanics of classical magnetic spin models to electronic structure calculations, quantum simulations, and simulations of soft condensed matter.
Computer Simulation Study of Collective Phenomena in Dense Suspensions of Red Blood Cells under Shear
by Timm KrügerThe rheology of dense red blood cell suspensions is investigated via computer simulations based on the lattice Boltzmann, the immersed boundary, and the finite element methods. The red blood cells are treated as extended and deformable particles immersed in the ambient fluid. In the first part of the work, the numerical model and strategies for stress evaluation are discussed. In the second part, the behavior of the suspensions in simple shear flow is studied for different volume fractions, particle deformabilities, and shear rates. Shear thinning behavior is recovered. The existence of a shear-induced transition from a tumbling to a tank-treading motion is demonstrated. The transition can be parameterized by a single quantity, namely the effective capillary number. It is the ratio of the suspension stress and the characteristic particle membrane stress. At the transition point, a strong increase in the orientational order of the red blood cells and a significant decrease of the particle diffusivity are observed. However, the average cell deformation shows no signature of the transition.
Computer Simulation Tools for X-ray Analysis: Scattering and Diffraction Methods (Graduate Texts in Physics)
by Sérgio Luiz MorelhãoThis book teaches the users on how to construct a library of routines to simulate scattering and diffraction by almost any kind of samples. The main goal of this book is to break down the huge barrier of difficulties faced by beginners from many fields (Engineering, Physics, Chemistry, Biology, Medicine, Material Science, etc.) in using X-rays as an analytical tool in their research. Besides fundamental concepts, MatLab routines are provided, showing how to test and implement the concepts. The major difficult in analysing materials by X-ray techniques is that it strongly depends on simulation software. This book teaches the users on how to construct a library of routines to simulate scattering and diffraction by almost any kind of samples. It provides to a young student the knowledge that would take more than 20 years to acquire by working on X-rays and relying on the available textbooks. The scientific productivity worldwide is growing at a breakneck pace, demanding ever more dynamic approaches and synergies between different fields of knowledge. To master the fundamentals of X-ray physics means the opportunity of working at an infiniteness of fields, studying systems where the organizational understanding of matter at the atomic scale is necessary. Since the discovery of X radiation, its usage as investigative tool has always been under fast expansion afforded by instrumental advances and computational resources. Developments in medical and technological fields have, as one of the master girders, the feasibility of structural analysis offered by X-rays. One of the major difficulties faced by beginners in using this fantastic tool lies in the analysis of experimental data. There are only few cases where it is possible to extract structural information directly from experiments. In most cases, structure models and simulation of radiation-matter interaction processes are essential. The advent of intense radiation sources and rapid development of nanotechnology constantly creates challenges that seek solutions beyond those offered by standard X-ray techniques. Preparing new researchers for this scenario of rapid and drastic changes requires more than just teaching theories of physical phenomena. It also requires teaching of how to implement them in a simple and efficient manner. In this book, fundamental concepts in applied X-ray physics are demonstrated through available computer simulation tools. Using MatLab, more than eighty routines are developed for solving the proposed exercises, most of which can be directly used in experimental data analysis. Therefore, besides X-ray physics, this book offers a practical programming course in modern high-level language, with plenty of graphic and mathematical tools.
Computer Simulation Validation: Fundamental Concepts, Methodological Frameworks, and Philosophical Perspectives (Simulation Foundations, Methods and Applications)
by Claus Beisbart Nicole J. SaamThis unique volume introduces and discusses the methods of validating computer simulations in scientific research. The core concepts, strategies, and techniques of validation are explained by an international team of pre-eminent authorities, drawing on expertise from various fields ranging from engineering and the physical sciences to the social sciences and history. The work also offers new and original philosophical perspectives on the validation of simulations.Topics and features: introduces the fundamental concepts and principles related to the validation of computer simulations, and examines philosophical frameworks for thinking about validation; provides an overview of the various strategies and techniques available for validating simulations, as well as the preparatory steps that have to be taken prior to validation; describes commonly used reference points and mathematical frameworks applicable to simulation validation; reviews the legal prescriptions, and the administrative and procedural activities related to simulation validation; presents examples of best practice that demonstrate how methods of validation are applied in various disciplines and with different types of simulation models; covers important practical challenges faced by simulation scientists when applying validation methods and techniques; offers a selection of general philosophical reflections that explore the significance of validation from a broader perspective.This truly interdisciplinary handbook will appeal to a broad audience, from professional scientists spanning all natural and social sciences, to young scholars new to research with computer simulations. Philosophers of science, and methodologists seeking to increase their understanding of simulation validation, will also find much to benefit from in the text.
Computer Simulations in Condensed Matter: From Materials to Chemical Biology. Volume 1 (Lecture Notes in Physics #703)
by Mauro Ferrario Giovanni Ciccotti Kurt BinderThis comprehensive collection of lectures by leading experts in the field introduces and reviews all relevant computer simulation methods and their applications in condensed matter systems. Volume 1 is an in-depth introduction to a vast spectrum of computational techniques for statistical mechanical systems of condensed matter. Volume 2 is a collection of state-of-the-art surveys on numerical experiments carried out for a great number of systems.
Computer Simulations in Condensed Matter: From Materials to Chemical Biology. Volume 2 (Lecture Notes in Physics #704)
by Mauro Ferrario Giovanni Ciccotti Kurt BinderThis extensive and comprehensive collection of lectures by world-leading experts in the field introduces and reviews all relevant computer simulation methods and their applications in condensed matter systems. Volume 2 offers surveys on numerical experiments carried out for a great number of systems, ranging from materials sciences to chemical biology, including supercooled liquids, spin glasses, colloids, polymers, liquid crystals, biological membranes and folding proteins.
Computer Simulations in Molecular Biology (Scientific Computation)
by Hiqmet KamberajThis book covers a range of topics in quantum mechanics and molecular dynamics simulation, including computational modeling and machine learning approaches. The book also provides a Python GUI and tutorials for simulating molecular biological systems and presents case studies of quantum mechanics simulations for predicting electronic properties. Its pedagogical formatting makes it easy for students to understand and follow and has been praised for providing clear and detailed explanations of complex topics. This book is ideal for graduate students and researchers in theoretical and computational biophysics, physics, chemistry, and materials science, as well as postgraduates in applied mathematics, computer science, and bioinformatics.
Computer Simulations in Science and Engineering: Concepts - Practices - Perspectives (The Frontiers Collection)
by Juan Manuel DuránThis book addresses key conceptual issues relating to the modern scientific and engineering use of computer simulations. It analyses a broad set of questions, from the nature of computer simulations to their epistemological power, including the many scientific, social and ethics implications of using computer simulations. The book is written in an easily accessible narrative, one that weaves together philosophical questions and scientific technicalities. It will thus appeal equally to all academic scientists, engineers, and researchers in industry interested in questions (and conceivable answers) related to the general practice of computer simulations.
Computer Simulations in Science and Technology Studies
by Petra Ahrweiler Nigel GilbertWhat is it about the structure and organisation of science and technology that has led to the spectacularly successful growth of knowledge during this century? This book explores this important and much debated question in an innovative way, by using computer simulations. The computer simulation of societies and social processes is a methodology which is rapidly becoming recognised for its potential in the social sciences. This book applies the tools of simulation systematically to a specific domain: science and technology studies. The book shows how computer simulation can be applied both to questions in the history and philosophy of science and to issues of concern to sociologists of science and technology. Chapters in the book demonstrate the use of simulation for clarifying the notion of creativity and for understanding the logical processes employed by eminent scientists to make their discoveries. The book begins with three introductory chapters. The first introduces simulation for the social sciences, surveying current work and explaining the advantages and pitfalls of this new methodology. The second and third chapters review recent work on theoretical aspects of social simulation, introducing fundamental concepts such as self organisation and complexity and relating these to the simulation of scientific discovery.