Mesoscale Modeling in Chemical Engineering Part II

Mesoscale Modeling in Chemical Engineering Part II

Author:

Publisher: Academic Press

Published: 2016-02-16

Total Pages: 422

ISBN-13: 0128039310

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Mesoscale Modeling in Chemical Engineering, a volume in the Advances in Chemical Engineering series provides the reader with personal views of authorities in the field. Subjects covered are not limited to the classical chemical engineering disciplines, with contributions connecting chemical engineering to related scientific fields, thus providing new ideas for additional thought. The book balances well developed areas such as process industry, transformation of materials, energy, and environmental issues with areas where applications of chemical engineering are more recent or emerging. - Contains reviews by leading authorities in the respective areas - Presents Up-to-date reviews of latest techniques in modeling of catalytic processes - Includes a mix of US and European authors, as well as academic/industrial/research institute perspectives - Contains the critical connections between computation and experimental methods


Kinetics and Thermodynamics of Multistep Nucleation and Self-Assembly in Nanoscale Materials, Volume 151

Kinetics and Thermodynamics of Multistep Nucleation and Self-Assembly in Nanoscale Materials, Volume 151

Author: Gregoire Nicolis

Publisher: John Wiley & Sons

Published: 2012-05-22

Total Pages: 352

ISBN-13: 111816783X

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The Advances in Chemical Physics series—the cutting edge of research in chemical physics The Advances in Chemical Physics series provides the chemical physics and physical chemistry fields with a forum for critical, authoritative evaluations of advances in every area of the discipline. Filled with cutting-edge research reported in a cohesive manner not found elsewhere in the literature, each volume of the Advances in Chemical Physics series presents contributions from internationally renowned chemists and serves as the perfect supplement to any advanced graduate class devoted to the study of chemical physics. This volume explores: Kinetics and thermodynamics of fluctuation-induced transitions in multistable systems (G. Nicolis and C. Nicolis) Dynamical rare event simulation techniques for equilibrium and nonequilibrium systems (Titus S. van Erp) Confocal depolarized dynamic light scattering (M. Potenza, T. Sanvito, V. Degiorgio, and M. Giglio) The two-step mechanism and the solution-crystal spinodal for nucleation of crystals in solution (Peter G. Vekilov) Experimental studies of two-step nucleation during two-dimensional crystallization of colloidal particles with short-range attraction (John R. Savage, Liquan Pei, and Anthony D. Dinsmore) On the role of metastable intermediate states in the homogeneous nucleation of solids from solution (James F. Lutsko) Effects of protein size on the high-concentration/low-concentration phase transition (Patrick Grosfils) Geometric constraints in the self-assembly of mineral dendrites and platelets (John J. Kozak) What can mesoscopic level in situ observations teach us about kinetics and thermodynamics of protein crystallization? (Mike Sleutel, Dominique Maes, and Alexander Van Driessche) The ability of silica to induce biomimetic crystallization of calcium carbonate (Matthias Kellermeier, Emilio Melero-GarcÍa, Werner Kunz, and Juan Manuel GarcÍa-Ruiz)


Models for Polymeric and Anisotropic Liquids

Models for Polymeric and Anisotropic Liquids

Author: Martin Kröger

Publisher: Springer Science & Business Media

Published: 2005-09-15

Total Pages: 256

ISBN-13: 9783540262107

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Models should be as simple as possible, but no simpler. For the physics of polymeric liquids, whose relevant lengths and time scales are out of reach for first principles calculations, this means that we have to choose a minimum set of sufficiently detailed descriptors such as architecture (linear, ring, branched), connectivity, semiflexibility, stretchability, excluded volume, and hydrodynamic interaction. These 'universal' fluids allow the prediction of material properties under external flow- or electrodynamic fields, the results being expressed in terms of reference units, specific for any particular chosen material. This book provides an introduction to the kinetic theory and computer simulation methods needed to handle these models and to interpret the results. Also included are a number of sample applications and computer codes.


Physics of Complex Colloids

Physics of Complex Colloids

Author: C. Bechinger

Publisher: IOS Press

Published: 2013-06-24

Total Pages: 639

ISBN-13: 1614992789

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Colloids are systems comprised of particles of mesoscopic size suspended in a liquid. They have recently been attracting increased attention from scientists and engineers due to the fact that they are nowadays present in many industrial products such as paints, oil additives, electronic ink displays and drugs. Colloids also serve as versatile model systems for phenomena and structures from solid-state physics, surface science and statistical mechanics, and can easily be studied using tabletop experiments to provide insight into processes not readily accessible in atomic systems. This book presents the lectures delivered at the 2012 Enrico Fermi School ‘Physics of Complex Colloids’, held in Varenna, Italy, in July 2012. The school addressed experimental, theoretical and numerical results and methods, and the lectures covered a broad spectrum of topics from the starting point of the synthesis of colloids and their use in commercial products. The lectures review the state-of-the-art of colloidal science in a pedagogical way, discussing both the basics and the latest results, and this book will serve as a reference for both students and experts in this rapidly growing field.


Phosphorylated Extracellular Matrix Proteins of Bone and Dentin

Phosphorylated Extracellular Matrix Proteins of Bone and Dentin

Author: Michel Goldberg

Publisher: Bentham Science Publishers

Published: 2012-09-11

Total Pages: 464

ISBN-13: 1608054659

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Phosphorylated Extracellular Matrix Proteins of Bone and Dentin is the second volume of the e-book series Frontiers between Science and Clinic in Odontology. The phosphorylated proteins of the extracellular matrix of bone and teeth play a crucial structural role in the two tissues. They also act as signaling molecules. Phosphorylated extracellular matrix proteins have been implicated in nucleation and mineralization of skeletal tissues. This e-book covers research on these specific proteins, including details about the cells producing these molecules, their impact on bone and teeth pathology (osteogenesis and dentinogenesis imperfecta) and the potential of these molecules in promoting of inhibiting mineralization. This e-book also explains processes under the control of some enzymes - TNAP and metalloproteases (MMPs) - such as intracellular regulation in bone and dentine, splicing, respective roles of cleavage products, SIBLINGs, nucleation and crystal growth and regulation. This second volume serves as a valuable reference to practicing odontologists, biology and biomaterials scientists and tissue engineers interested in protein research related to tooth and bone formation.


The Hierarchic Theory of Liquids and Solids

The Hierarchic Theory of Liquids and Solids

Author: Aleksandr Ivanovich Kaivarainen

Publisher: Nova Publishers

Published: 2008

Total Pages: 396

ISBN-13: 9781600219016

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Subject Scope: Condensed Matter. This book presents a review of an original Hierarchic theory of condensed matter, general for liquids and solids and its numerous applications. Computer programs based on a new theory were used for comprehensive simulations of water and ice physical properties and validation of the theory. Condensed matter is considered as a system of 3D standing waves (collective excitations) of different nature: thermal de Broglie waves, IR photons and thermal phonons. Quantitative interrelation between microscopic, mesoscopic (as intermediate) and macroscopic properties of condensed matter were found. New theories of total internal energy, including contributions of kinetic and potential energies, heat capacity, surface tension, vapour pressure, thermal conductivity, viscosity and self-diffusion are described.


Finely Dispersed Particles

Finely Dispersed Particles

Author: Aleksandar M. Spasic

Publisher: CRC Press

Published: 2005-10-14

Total Pages: 936

ISBN-13: 1420027662

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Over the last decade, the biggest advances in physical chemistry have come from thinking smaller. The leading edge in research pushes closer to the atomic frontier with every passing year. Collecting the latest developments in the science and engineering of finely dispersed particles and related systems, Finely Dispersed Particles: Micro-, Nano-, a


Handbook of Materials Modeling

Handbook of Materials Modeling

Author: Sidney Yip

Publisher: Springer Science & Business Media

Published: 2007-11-17

Total Pages: 2903

ISBN-13: 1402032862

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The first reference of its kind in the rapidly emerging field of computational approachs to materials research, this is a compendium of perspective-providing and topical articles written to inform students and non-specialists of the current status and capabilities of modelling and simulation. From the standpoint of methodology, the development follows a multiscale approach with emphasis on electronic-structure, atomistic, and mesoscale methods, as well as mathematical analysis and rate processes. Basic models are treated across traditional disciplines, not only in the discussion of methods but also in chapters on crystal defects, microstructure, fluids, polymers and soft matter. Written by authors who are actively participating in the current development, this collection of 150 articles has the breadth and depth to be a major contributor toward defining the field of computational materials. In addition, there are 40 commentaries by highly respected researchers, presenting various views that should interest the future generations of the community. Subject Editors: Martin Bazant, MIT; Bruce Boghosian, Tufts University; Richard Catlow, Royal Institution; Long-Qing Chen, Pennsylvania State University; William Curtin, Brown University; Tomas Diaz de la Rubia, Lawrence Livermore National Laboratory; Nicolas Hadjiconstantinou, MIT; Mark F. Horstemeyer, Mississippi State University; Efthimios Kaxiras, Harvard University; L. Mahadevan, Harvard University; Dimitrios Maroudas, University of Massachusetts; Nicola Marzari, MIT; Horia Metiu, University of California Santa Barbara; Gregory C. Rutledge, MIT; David J. Srolovitz, Princeton University; Bernhardt L. Trout, MIT; Dieter Wolf, Argonne National Laboratory.