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The use of mathematical modeling in engineering allows for a significant reduction of material costs associated with design, production, and operation of technical objects, but it is important for an engineer to use the available computational approaches in modeling correctly. Taking into account the level of modern computer technology, this new vo
This new book focuses on nanomaterial development as well as investigations of combustion and explosion processes. It presents valuable information on the modeling of processes and on quantum chemical calculations and leading-edge research from around the world in this dynamic field, focusing on concepts above formal experimental techniques and theoretical methods of chemical physics for micro- and nanotechnologies. Also presented are non-linear kinetic appearances and their possible applications.
A solid introduction, enabling the reader to successfully formulate, construct, simplify, evaluate and use mathematical models in chemical engineering.
An easy to understand guide covering key principles of mathematical modelling and simulation in chemical engineering.
Computational Multiscale Modeling of Multiphase Nanosystems: Theory and Applications presents a systematic description of the theory of multiscale modeling of nanotechnology applications in various fields of science and technology. The problems of computing nanoscale systems at different structural scales are defined, and algorithms are given for their numerical solutions by the quantum/continuum mechanics, molecular dynamics, and mesodynamics methods. Emphasis is given to the processes of the formation, movement, and interaction of nanoparticles; the formation of nanocomposites; and the processes accompanying the application of nanocomposites. The book concentrates on different types of nanosystems: solid, liquid, gaseous, and multi-phase, consisting of various elements interacting with each other, and with other elements of the nanosystem and with the environment. The book includes a large number of examples of numerical modeling of nanosystems. The valuable information presented here will be useful to engineers, researchers, and postgraduate students engaged in the design and research in the field of nanotechnology.
This volume presents a selection of important information and discussion on the new scientific trend of chemical mesoscopics and also sheds new knowledge on the science of nanomaterials, processes of nanochemistry, and nanoengineering. The volume explores nanomaterial development as well as investigations of processes and modeling. It provides new perspectives on processes, while also discussing new methods of treatment polymeric materials and different material modification, including by super small quantities of metal/carbon nanocomposites. This volume will be a valuable resource on new trends on chemical mesoscopics, nanotechnology, and nanoengineering for researchers, scientists, professors, postgraduate students, and others.
This new volume, Research Methodologies and Practical Applications of Chemistry, presents a detailed analysis of current experimental and theoretical approaches surrounding chemical science. With an emphasis on multidisciplinary as well as interdisciplinary applications, the book extensively reviews fundamental principles and presents recent research to help show logical connections between the theory and application of modern chemistry concepts. It also emphasizes the behavior of materials from the molecular point of view. The burgeoning field of chemistry and chemical science has led to many recent technological innovations and discoveries. Understanding the impact of these technologies on business, science, and industry is an important first step in developing applications for a variety of settings and contexts. The aim of this book is to present research that has transformed this discipline and aided its advancement. The book examines the strengths and future potential of chemical technologies in a variety of industries.
Bringing together the world's leading researchers and practitioners of computational mechanics, these new volumes meet and build on the eight key challenges for research and development in computational mechanics.Researchers have recently identified eight critical research tasks facing the field of computational mechanics. These tasks have come about because it appears possible to reach a new level of mathematical modelling and numerical solution that will lead to a much deeper understanding of nature and to great improvements in engineering design.The eight tasks are: - The automatic solution of mathematical models - Effective numerical schemes for fluid flows - The development of an effective mesh-free numerical solution method - The development of numerical procedures for multiphysics problems - The development of numerical procedures for multiscale problems - The modelling of uncertainties - The analysis of complete life cycles of systems - Education - teaching sound engineering and scientific judgement Readers of Computational Fluid and Solid Mechanics 2003 will be able to apply the combined experience of many of the world's leading researchers to their own research needs. Those in academic environments will gain a better insight into the needs and constraints of the industries they are involved with; those in industry will gain a competitive advantage by gaining insight into the cutting edge research being carried out by colleagues in academia. Features - Bridges the gap between academic researchers and practitioners in industry - Outlines the eight main challenges facing Research and Design in Computational mechanics and offers new insights into the shifting the research agenda - Provides a vision of how strong, basic and exciting education at university can be harmonized with life-long learning to obtain maximum value from the new powerful tools of analysis
Presents a thorough grounding in the techniques of mathematical modelling, and proceeds to explore a range of classical and continuum models from an array of disciplines.
This volume contains review articles and original results obtained in various fields of modern science using mathematical simulation methods. The basis of the articles are the plenary and some section reports that were made and discussed at the Fourth International Mathematical Simulation Conference, held in Moscow on June 27 through July 1, 2000. The conference was devoted to the following scientific areas: • mathematical and computer discrete systems models; • non-linear excitation in condensed media; • complex systems evolution; • mathematical models in economics; • non-equilibrium processes kinematics; • dynamics and structure of the molecular and biomolecular systems; • mathematical transfer models in non-linear systems; • numerical simulation and algorithms; • turbulence and determined chaos; • chemical physics of polymer. This conference was supported by the Russian Ministry of Education, Russian foundation for Basic Research and Federal Program "Integration". This volume contains the following sections: 1. models of non-linear phenomena in physics; 2. numerical methods and computer simulations; 3. mathematical computer models of discrete systems; 4. mathematical models in economics; 5. non-linear models in chemical physics and physical chemistry; 6. mathematical models of transport processes in complex systems. In Sections One and Five a number of fundamental and sufficiently general problems, concerning real physical and physical-chemical systems simulation, is discussed.