Theory of Simple Liquids

Author: Jean-Pierre Hansen,I.R. McDonald

Publisher: Elsevier

ISBN: 9780080455075

Category: Science

Page: 428

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The third edition of Theory of Simple Liquids is an updated, advanced, but self-contained introduction to the principles of liquid-state theory. It presents the modern, molecular theory of the structural, thermodynamic interfacial and dynamical properties of the liquid phase of materials constituted of atoms, small molecules or ions. This book leans on concepts and methods form classical Statistical Mechanics in which theoretical predictions are systematically compared with experimental data and results from numerical simulations. The overall layout of the book is similar to that of the previous two editions however, there are considerable changes in emphasis and several key additions including: •up-to-date presentation of modern theories of liquid-vapour coexistence and criticality •areas of considerable present and future interest such as super-cooled liquids and the glass transition •the area of liquid metals, which has grown into a mature subject area, now presented as part of the chapter ionic liquids •Provides cutting-edge research in the principles of liquid-state theory •Includes frequent comparisons of theoretical predictions with experimental and simulation data •Suitable for researchers and post-graduates in the field of condensed matter science (Physics, Chemistry, Material Science), biophysics as well as those in the oil industry

Theory of Simple Liquids

Author: Jean-Pierre Hansen,Ian R. McDonald

Publisher: Elsevier

ISBN: 0080571018

Category: Science

Page: 556

View: 446

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This book gives a comprehensive and up-to-date treatment of the theory of "simple" liquids. The new second edition has been rearranged and considerably expanded to give a balanced account both of basic theory and of the advances of the past decade. It presents the main ideas of modern liquid state theory in a way that is both pedagogical and self-contained. The book should be accessible to graduate students and research workers, both experimentalists and theorists, who have a good background in elementary mechanics. Compares theoretical deductions with experimental results Molecular dynamics Monte Carlo computations Covers ionic, metallic, and molecular liquids

Physics of Simple Liquids

Author: H. N. V. Temperley,John Shipley Rowlinson,G. S. Rushbrooke

Publisher: N.A

ISBN: N.A

Category: Kinetic theory of liquids

Page: 713

View: 660

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Strömungsmechanik nichtnewtonscher Fluide

Author: Gert Böhme

Publisher: Springer-Verlag

ISBN: 3322801403

Category: Science

Page: 352

View: 9910

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Die Grundlagen und Methoden, die zur theoretischen Modellierung und zur Analyse von Strömungsvorgängen mit nicht-newtonschen Fluiden erforderlich sind, werden in diesem Lehrbuch vorgestellt. Zunächst werden die kinematischen, die kontinuumsmechanischen und die stofflichen Grundlagen ausführlich erläutert. Die Anwendung des Basiswissens erfolgt exemplarisch anhand ausgewählter Strömungsvorgänge, die maßgeblich von den nichtlinearen Fließeigenschaften, von den Normalspannungsdifferenzen oder vom Gedächtnis der Flüssigkeiten beeinflusst werden. Dabei haben sich die Inhalte, die Schwerpunkte und die Beispiele gegenüber der ersten Auflage wesentlich geändert. Erstmalig in einem deutschsprachigen Lehrbuch werden auch die Grundzüge einer numerischen Strömungssimulation unter Berücksichtigung komplexer rheologischer Stoffmodelle behandelt.

The Potential Distribution Theorem and Models of Molecular Solutions

Author: Tom L. Beck,Michael E. Paulaitis,Lawrence R. Pratt

Publisher: Cambridge University Press

ISBN: 1139457632

Category: Technology & Engineering

Page: N.A

View: 9210

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An understanding of statistical thermodynamic molecular theory is fundamental to the appreciation of molecular solutions. This complex subject has been simplified by the authors with down-to-earth presentations of molecular theory. Using the potential distribution theorem (PDT) as the basis, the text provides a discussion of practical theories in conjunction with simulation results. The authors discuss the field in a concise and simple manner, illustrating the text with useful models of solution thermodynamics and numerous exercises. Modern quasi-chemical theories that permit statistical thermodynamic properties to be studied on the basis of electronic structure calculations are given extended development, as is the testing of those theoretical results with ab initio molecular dynamics simulations. The book is intended for students taking up research problems of molecular science in chemistry, chemical engineering, biochemistry, pharmaceutical chemistry, nanotechnology and biotechnology.

Molecular Theory of Solvation

Author: F. Hirata

Publisher: Springer Science & Business Media

ISBN: 1402025904

Category: Science

Page: 358

View: 5888

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Molecular Theory of Solvation presents the recent progress in the statistical mechanics of molecular liquids applied to the most intriguing problems in chemistry today, including chemical reactions, conformational stability of biomolecules, ion hydration, and electrode-solution interface. The continuum model of "solvation" has played a dominant role in describing chemical processes in solution during the last century. This book discards and replaces it completely with molecular theory taking proper account of chemical specificity of solvent. The main machinery employed here is the reference-interaction-site-model (RISM) theory, which is combined with other tools in theoretical chemistry and physics: the ab initio and density functional theories in quantum chemistry, the generalized Langevin theory, and the molecular simulation techniques. This book will be of benefit to graduate students and industrial scientists who are struggling to find a better way of accounting and/or predicting "solvation" properties.

Theory of Liquids and Other Disordered Media

A Short Introduction

Author: Walter Schirmacher

Publisher: Springer

ISBN: 3319069500

Category: Science

Page: 167

View: 8641

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This set of lectures provides an introduction to the structure, thermodynamics and dynamics of liquids, binary solutions and polymers at a level that will enable graduate students and non-specialist researchers to understand more specialized literature and to possibly start their own work in this field. Part I starts with the introduction of distribution functions, which describe the statistical arrangements of atoms or molecules in a simple liquid. The main concepts involve mean field theories like the Perkus-Yevick theory and the random phase approximation, which relate the forces to the distribution functions. In order to provide a concise, self-contained text, an understanding of the general statistical mechanics of an interacting many-body system is assumed. The fact that in a classic liquid the static and dynamic aspects of such a system can be discussed separately forms the basis of the two-fold structure of this approach. In order to allow polymer melts and solutions to be discussed, a short chapter acquaints readers with scaling concepts by discussing random walks and fractals. Part II of the lecture series is essentially devoted to the presentation of the dynamics of simple and complex liquids in terms of the generalized hydrodynamics concept, such as that introduced by Mori and Zwanzig. A special topic is a comprehensive introduction of the liquid-glass transition and its discussion in terms of a mode-coupling theory.

Transport Coefficients of Fluids

Author: Byung Chan Eu

Publisher: Springer Science & Business Media

ISBN: 3540282165

Category: Science

Page: 408

View: 8182

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In this monograph, the density ?uctuation theory of transport coe?cients of simple and complex liquids is described together with the kinetic theory of liquids, the generic van der Waals equation of state, and the modi?ed free volume theory. The latter two theories are integral parts of the density ?- tuation theory, which enables us to calculate the density and temperature dependence of transport coe?cients of liquids from intermolecular forces. The terms nanoscience and bioscience are the catch phrases currently in fashion in science. It seems that much of the fundamentals remaining unsolved or poorly understood in the science of condensed matter has been overshadowed by the frenzy over the more glamorous disciplines of the former, shunned by novices, and are on the verge of being forgotten. The transport coe?cients of liquids and gases and related thermophysical properties of matter appear to be one such area in the science of macroscopic properties of molecular systems and statisticalmechanicsofcondensedmatter. Evennano-andbiomaterials,h- ever, cannot be fully and appropriately understood without ?rm grounding and foundations in the macroscopic and molecular theories of transport pr- ertiesandrelatedthermophysicalpropertiesofmatterinthecondensedphase. Oneisstilldealingwithsystemsmadeupofnotafewparticlesbutamultitude of them, often too many to count, to call them few-body problems that can be understoodwithoutthehelpofstatisticalmechanicsandmacroscopicphysics. In the density ?uctuation theory of transport coe?cients, the basic approach taken is quite di?erent from the approaches taken in the conventional kinetic theories of gases and liquids.

Handbook of Solvents

Author: George Wypych

Publisher: ChemTec Publishing

ISBN: 1895198240

Category: Electronic books

Page: 1675

View: 4826

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A comprehensive, extensive textual analysis of the principles of solvent selection and use, the handbook is intended to help formulators select ideal solvents, safety coordinators to protect workers, and legislators and inspectors to define and implement technically correct public safeguards for use, handling, and disposal.

New Approaches to Problems in Liquid State Theory

Inhomogeneities and Phase Separation in Simple, Complex and Quantum Fluids

Author: Carlo Caccamo,Jean-Pierre Hansen,George Stell

Publisher: Springer Science & Business Media

ISBN: 9401145644

Category: Science

Page: 521

View: 9712

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The theory of simple and complex fluids has made considerable recent progress, due to the emergence of new concepts and theoretical tools, and also to the availability of a large body of new experimental data on increas ingly complex systems, as well as far-reaching methodological developments in numerical simulations. This AS! aimed at providing a comprehensive overview of the most significant theoretical developments, supplemented by a few presentations of cutting-edge simulation and experimental work. The impact of the Institute in the overall landscape of Statistical Mechanics received an important recognition with its inclusion in the list of satellite events of STATPHYS20, the triennal international conference on Statistical Physics held in Paris in July 1998. These Proceedings contain the texts of the 13 Lecture Courses and 9 Invited Seminars delivered at Patti. Two clear trends emerge from these Proceedings: first, the diversity of new and unexpected theoretical results relating to classic models of liq uids, which have recently been subjected to fresh scrutiny; and secondly the parallel emergence of new concepts, models and methods, aimed at investigating complex fluids and phenomena, like the phase behaviour of fluids in pores, macromolecular assemblies, and the glass transition. Many of the new tools have their roots in traditional liquid state theory, and, in conjunction with fresh input from related fields, allow it wider applicability.

An Introduction to the Statistical Theory of Classical Simple Dense Fluids

Author: G.H.A. Cole

Publisher: Elsevier

ISBN: 1483214591

Category: Technology & Engineering

Page: 296

View: 6072

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An Introduction to the Statistical Theory of Classical Simple Dense Fluids covers certain aspects of the study of dense fluids, based on the analysis of the correlation effects between representative small groupings of molecules. The book starts by discussing empirical considerations including the physical characteristics of fluids; measured molecular spatial distribution; scattering by a continuous medium; the radial distribution function; the mean potential; and the molecular motion in liquids. The text describes the application of the theories to the description of dense fluids (i.e. interparticle force, classical particle trajectories, and the Liouville Theorem) and the deduction of expressions for the fluid thermodynamic functions. The theory of equilibrium short-range order by using the concept of closure approximation or total correlation; some numerical consequences of the equilibrium theory; and irreversibility are also looked into. The book further tackles the kinetic derivation of the Maxwell-Boltzmann (MB) equation; the statistical derivation of the MB equation; the movement to equilibrium; gas in a steady state; and viscosity and thermal conductivity. The text also discusses non-equilibrium liquids. Physicists, chemists, and engineers will find the book invaluable.

Theory and Simulation of Hard-Sphere Fluids and Related Systems

Author: Angel Mulero

Publisher: Springer Science & Business Media

ISBN: 3540787666

Category: Science

Page: 546

View: 4625

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Hard spheres and related objects (hard disks and mixtures of hard systems) are paradigmatic systems: indeed, they have served as a basis for the theoretical and numerical development of a number of fields, such as general liquids and fluids, amorphous solids, liquid crystals, colloids and granular matter, to name but a few. The present volume introduces and reviews some important basics and progress in the study of such systems. Their structure, thermodynamic properties, equations of state, as well as kinetic and transport properties are considered from different and complementary points of view. This book addresses graduate students, lecturers as well as researchers in statistical mechanics, physics of liquids, physical chemistry and chemical engineering.

Statistical Mechanics of Nonequilibrium Liquids

Author: Denis J. Evans,Gary P. Morriss

Publisher: Elsevier

ISBN: 1483260453

Category: Science

Page: 316

View: 3700

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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.

Liquid Surfaces and Interfaces

Synchrotron X-ray Methods

Author: Peter S. Pershan,Mark Schlossman

Publisher: Cambridge University Press

ISBN: 1139536117

Category: Technology & Engineering

Page: N.A

View: 9431

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The availability of synchrotron x-ray sources and the subsequent developments described in this book have led to substantial progress in our understanding of molecular ordering at liquid interfaces. This practical guide enables graduate students and researchers working in physics, chemistry, biology and materials science to understand and carry out experimental investigations into the basic physical and chemical properties of liquid surfaces and interfaces. The book examines the surfaces of bulk liquids, thin wetting films and buried liquid-liquid interfaces. It discusses experiments on simple and complex fluids, including pure water and organic liquids, liquid crystals, liquid metals, electrified liquid-liquid interfaces and interfacial monolayers of amphiphiles, nanoparticles, polymers and biomolecules. A detailed description of the apparatus and techniques required for these experiments is provided, and theoretical approaches to data analysis are described, including approximate methods such as the Master formula, the Born approximation, Parratt's algorithm and the Distorted Wave Approximation.

Phonons in Condensed Materials

Author: N.A

Publisher: Allied Publishers

ISBN: 9788177645903

Category: Condensed matter

Page: 442

View: 7677

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Papers presented at the International Conference on Phonons in Condensed Materials, held at Bhopal during 20-23 January 2003.

VDI-Wärmeatlas

Author: VDI Gesellschaft

Publisher: Springer

ISBN: 9783540255048

Category: Science

Page: 1500

View: 618

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Der VDI-Wärmeatlas ist nach wie vor ein unentbehrliches Arbeitsmittel für jeden Praktiker, der sich mit Fragen zur Wärme- und Stoffübertragung beschäftigt. Für die tägliche Arbeit mit Tabellen und Stoffwerten ist das Ringbuch mit dem Vorteil des Herausnehmens der Blätter und deren beliebiger Neuordnung eine bequeme Variante. Das Werk ermöglicht sowohl die technisch als auch wirtschaftlich optimale Auslegung verfahrenstechnischer Apparate und Anlagen. Für diese 10. Auflage wurden alle Beiträge einem umfassenden fachlichen Prüfverfahren unterzogen, das dem Nutzer ein Höchstmaß an Sicherheit bietet, dass die Daten, Berechnungsverfahren und Aussagen dem neuesten Stand des Wissens entsprechen. Um Redundanzen zu minimieren, wurde zum Teil neu strukturiert. Zahlreiche Aktualisierungen und Ergänzungen wurden aufgenommen, einige Beiträge sind völlig neu (v.a. in den Teilen D: Stoffwerte und Zustandsgrößen und L: Druckverlust).