Theory Of Molecular Fluids

Author : Christopher G. Gray,Keith E. Gubbins,Christopher G. Joslin
Publisher : Oxford University Press
Page : 785 pages
File Size : 55,7 Mb
Release : 2011-10-13
Category : Science
ISBN : 9780191004872

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Theory of Molecular Fluids by Christopher G. Gray,Keith E. Gubbins,Christopher G. Joslin Pdf

Existing texts on the statistical mechanics of liquids treat only spherical molecules. However, nearly all fluids of practical interest are composed of non-spherical molecules that are often dipolar or exhibit other kinds of electrostatic forces. This book describes the statistical mechanical theory of fluids of non-spherical molecules and its application to the calculation of physical properties, and is a sequel to Theory of Molecular Fluids. Volume 1: Fundamentals by C.G. Gray and K.E. Gubbins. The emphasis is on the new phenomena that arise due to the non-spherical nature of the intermolecular forces, such as new phase transitions, structural features and dielectric effects. It contains chapters on the thermodynamic properties of pure and mixed fluids, surface properties, X-ray and neutron diffraction structure factors, dielectric properties and spectroscopic properties. The book is aimed at beginning graduate students and research workers in chemistry, physics, materials science and engineering.

Author : C. G. Gray,K. E. Gubbins
Publisher : Oxford University Press
Page : 641 pages
File Size : 53,6 Mb
Release : 1984-12-06
Category : Science
ISBN : 9780191036705

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Theory of Molecular Fluids by C. G. Gray,K. E. Gubbins Pdf

Theory of Molecular Fluids I: Fundamentals

Author : C. G. GRAY,K. E. Gubbins
Publisher : Unknown
Page : 128 pages
File Size : 51,7 Mb
Release : 1984
Category : Electronic
ISBN : OCLC:1074763239

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Theory of Molecular Fluids by C. G. GRAY,K. E. Gubbins Pdf

Author : Sture Nordholm,Jan Forsman,Cliff Woodward,Ben Freasier,Zareen Abbas,Robert Penfold
Publisher : Elsevier
Page : 0 pages
File Size : 41,8 Mb
Release : 2018-09-07
Category : Technology & Engineering
ISBN : 0128111364

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Generalized van der Waals Theory of Molecular Fluids in Bulk and at Surfaces by Sture Nordholm,Jan Forsman,Cliff Woodward,Ben Freasier,Zareen Abbas,Robert Penfold Pdf

Generalized van der Waals Theory of Molecular Fluids in Bulk and at Surfaces presents successful research on the development of a new density theory of fluids that makes it possible to understand and predict a wide range of properties and phenomena. The book brings together recent advances relating to the Generalized van der Waals Theory and its use in fluid property calculations. The mathematics presentation is oriented to an audience of varying backgrounds, and readers will find exercises that can be used as a textbook for a course at the upper undergraduate or graduate level in physics or chemistry. In addition, it is ideal for scientists from other areas, such as geophysics, oceanography and molecular biology who are interested in learning about, and understanding, molecular fluids.

Author : Jean-Pierre Hansen,Ian R. McDonald
Publisher : Elsevier
Page : 556 pages
File Size : 51,7 Mb
Release : 1990-09-24
Category : Science
ISBN : 9780080571010

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Theory of Simple Liquids by Jean-Pierre Hansen,Ian R. McDonald Pdf

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

Author : C. G. Gray,Keith E. Gubbins,Christopher G. Joslin
Publisher : Unknown
Page : 771 pages
File Size : 42,9 Mb
Release : 2011
Category : SCIENCE
ISBN : 0191729043

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Theory of Molecular Fluids by C. G. Gray,Keith E. Gubbins,Christopher G. Joslin Pdf

Existing texts on liquid theory are limited to simple liquids of spherical molecules, but nearly all liquids of practical interest have molecules that are non-spherical, resulting in more diverse phenomena. This text provides the molecular theory for such liquids, and describes applications to a wide range of physical properties.

Author : Christopher G. Gray,Keith E. Gubbins,Christopher G. Joslin
Publisher : Unknown
Page : 0 pages
File Size : 45,7 Mb
Release : 2011
Category : Electronic
ISBN : OCLC:901675895

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Theory of Molecular Fluids by Christopher G. Gray,Keith E. Gubbins,Christopher G. Joslin Pdf

Author : Herbert S. Green
Publisher : Unknown
Page : 300 pages
File Size : 47,8 Mb
Release : 1969
Category : Science
ISBN : UOM:39015017205355

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The Molecular Theory of Fluids by Herbert S. Green Pdf

Author : Richard J. Sadus
Publisher : Elsevier
Page : 617 pages
File Size : 45,8 Mb
Release : 2023-09-16
Category : Science
ISBN : 9780323910552

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Molecular Simulation of Fluids by Richard J. Sadus Pdf

Molecular simulation allows researchers unique insight into the structures and interactions at play in fluids. Since publication of the first edition of Molecular Simulation of Fluids, novel developments in theory, algorithms and computer hardware have generated enormous growth in simulation capabilities. This 2nd edition has been fully updated and expanded to highlight this recent progress, encompassing both Monte Carlo and molecular dynamic techniques, and providing details of theory, algorithms and both serial and parallel implementations. Beginning with a clear introduction and review of theoretical foundations, the book goes on to explore intermolecular potentials before discussing the calculation of molecular interactions in more detail. Monte Carlo simulation and integrators for molecular dynamics are then discussed further, followed by non-equilibrium molecular dynamics and molecular simulation of ensembles and phase equilibria. The use of object-orientation is examined in detail, with working examples coded in C++. Finally, practical parallel simulation algorithms are discussed using both MPI and GPUs, with the latter coded in CUDA. Drawing on the extensive experience of its expert author, Molecular Simulation of Fluids: Theory, Algorithms, Object-Orientation, and Parallel Computing 2nd Edition is a practical, accessible guide to this complex topic for all those currently using, or interested in using, molecular simulation to study fluids. Fully updated and revised to reflect advances in the field, including new chapters on intermolecular potentials and parallel algorithms Covers the application of both MPI and GPU programming to molecular simulation Covers a wide range of simulation topics using both Monte Carlo and molecular dynamics approaches Provides access to downloadable simulation code, including GPU code using CUDA, to encourage practice and support learning

Author : Kostya Trachenko
Publisher : Cambridge University Press
Page : 227 pages
File Size : 55,9 Mb
Release : 2023-08-17
Category : Science
ISBN : 9781009355506

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Theory of Liquids by Kostya Trachenko Pdf

Of the three basic states of matter, liquid is perhaps the most complex. While its flow properties are described by fluid mechanics, its thermodynamic properties are often neglected, and for many years it was widely believed that a general theory of liquid thermodynamics was unattainable. In recent decades that view has been challenged, as new advances have finally enabled us to understand and describe the thermodynamic properties of liquids. This book explains the recent developments in theory, experiment and modelling that have enabled us to understand the behaviour of excitations in liquids and the impact of this behaviour on heat capacity and other basic properties. Presented in plain language with a focus on real liquids and their experimental properties, this book is a useful reference text for researchers and graduate students in condensed matter physics and chemistry as well as for advanced courses covering the theory of liquids.

Author : Joseph O. Hirschfelder,Charles F. Curtiss,R. Byron Bird
Publisher : John Wiley & Sons
Page : 1283 pages
File Size : 52,8 Mb
Release : 1964-01-15
Category : Science
ISBN : 9780471400653

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The Molecular Theory of Gases and Liquids by Joseph O. Hirschfelder,Charles F. Curtiss,R. Byron Bird Pdf

An essential cross-disciplinary reference for molecular interactions Molecular Theory of Gases and Liquids offers a rigorous, comprehensive treatment of molecular characteristics and behaviors in the gaseous and fluid states. A unique cross-disciplinary approach provides useful insight for students of chemistry, chemical engineering, fluid dynamics, and a variety of related fields, with thorough derivations and in-depth explanations throughout. Appropriate for graduate students and working scientists alike, this book details advanced concepts without sacrificing depth of coverage or technical detail.

Author : Sture Nordholm,Jan Forsman,Cliff Woodward,Ben Freasier,Zareen Abbas,Robert Penfold
Publisher : Elsevier
Page : 380 pages
File Size : 47,8 Mb
Release : 2018-09-05
Category : Technology & Engineering
ISBN : 9780128111901

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Generalized van der Waals Theory of Molecular Fluids in Bulk and at Surfaces by Sture Nordholm,Jan Forsman,Cliff Woodward,Ben Freasier,Zareen Abbas,Robert Penfold Pdf

Generalized van der Waals Theory of Molecular Fluids in Bulk and at Surfaces presents successful research on the development of a new density theory of fluids that makes it possible to understand and predict a wide range of properties and phenomena. The book brings together recent advances relating to the Generalized van der Waals Theory and its use in fluid property calculations. The mathematics presentation is oriented to an audience of varying backgrounds, and readers will find exercises that can be used as a textbook for a course at the upper undergraduate or graduate level in physics or chemistry. In addition, it is ideal for scientists from other areas, such as geophysics, oceanography and molecular biology who are interested in learning about, and understanding, molecular fluids. Presents an approximate, but fully derived and physically explained, theory of molecular fluids to facilitate broad applications Derives a density functional theory of classical fluids and applies it to obtain equations of state, as well as non-uniform fluid properties, e.g., surface tension and adsorption Demonstrates how the theory can be applied to complex multi-center molecules forming a polymer fluid Provides user-friendly programs to redraw figures for variable parameters and to perform calculations in particular applications Includes a set of exercises to support use of the book in a course

Author : Jean-Pierre Hansen,I.R. McDonald
Publisher : Elsevier
Page : 428 pages
File Size : 49,6 Mb
Release : 2006-02-08
Category : Science
ISBN : 0080455077

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Theory of Simple Liquids by Jean-Pierre Hansen,I.R. McDonald Pdf

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

Author : Roland Kjellander
Publisher : CRC Press
Page : 544 pages
File Size : 50,5 Mb
Release : 2019-07-30
Category : Science
ISBN : 9781482244021

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Statistical Mechanics of Liquids and Solutions by Roland Kjellander Pdf

The statistical mechanical theory of liquids and solutions is a fundamental area of physical sciences with important implications for many industrial applications. This book shows how you can start from basic laws for the interactions and motions of microscopic particles and calculate how macroscopic systems of these particles behave, thereby explaining properties of matter at the scale that we perceive. Using this microscopic, molecular approach, the text emphasizes clarity of physical explanations for phenomena and mechanisms relevant to fluids, addressing the structure and behavior of liquids and solutions under various conditions. A notable feature is the author’s treatment of forces between particles that include nanoparticles, macroparticles, and surfaces. The book also provides an expanded, in-depth treatment of polar liquids and electrolytes.

Author : J. R. Solana
Publisher : CRC Press
Page : 400 pages
File Size : 42,6 Mb
Release : 2013-03-22
Category : Science
ISBN : 9781439807767

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Perturbation Theories for the Thermodynamic Properties of Fluids and Solids by J. R. Solana Pdf

This book, Perturbation Theories for the Thermodynamic Properties of Fluids and Solids, provides a comprehensive review of current perturbation theories-as well as integral equation theories and density functional theories-for the equilibrium thermodynamic and structural properties of classical systems. Emphasizing practical applications, the text