Computational Materials Modeling And Simulation Of Nanostructured Materials And Systems


Computational Materials Modeling And Simulation Of Nanostructured Materials And Systems
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Computational Materials Modeling And Simulation Of Nanostructured Materials And Systems


Computational Materials Modeling And Simulation Of Nanostructured Materials And Systems
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Author : Thomas S. Gates
language : en
Publisher:
Release Date : 2003

Computational Materials Modeling And Simulation Of Nanostructured Materials And Systems written by Thomas S. Gates and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2003 with Composite materials categories.




Computational Materials


Computational Materials
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Author : National Aeronautics and Space Administration (NASA)
language : en
Publisher: Createspace Independent Publishing Platform
Release Date : 2018-06-20

Computational Materials written by National Aeronautics and Space Administration (NASA) and has been published by Createspace Independent Publishing Platform this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018-06-20 with categories.


The paper provides details on the structure and implementation of the Computational Materials program at the NASA Langley Research Center. Examples are given that illustrate the suggested approaches to predicting the behavior and influencing the design of nanostructured materials such as high-performance polymers, composites, and nanotube-reinforced polymers. Primary simulation and measurement methods applicable to multi-scale modeling are outlined. Key challenges including verification and validation of models are highlighted and discussed within the context of NASA's broad mission objectives. Gates, Thomas S. and Hinkley, Jeffrey A. Langley Research Center NASA/TM-2003-212163, L-18267, NAS 1.15:212163



Computational Modelling Of Nanomaterials


Computational Modelling Of Nanomaterials
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Author : Panagiotis Grammatikopoulos
language : en
Publisher: Elsevier
Release Date : 2020-09-30

Computational Modelling Of Nanomaterials written by Panagiotis Grammatikopoulos and has been published by Elsevier this book supported file pdf, txt, epub, kindle and other format this book has been release on 2020-09-30 with Technology & Engineering categories.


Due to their small size and their dependence on very fast phenomena, nanomaterials are ideal systems for computational modelling. This book provides an overview of various nanosystems classified by their dimensions: 0D (nanoparticles, QDs, etc.), 1D (nanowires, nanotubes), 2D (thin films, graphene, etc.), 3D (nanostructured bulk materials, devices). Fractal dimensions, such as nanoparticle agglomerates, percolating films and combinations of materials of different dimensionalities are also covered (e.g. epitaxial decoration of nanowires by nanoparticles, i.e. 0D+1D nanomaterials). For each class, the focus will be on growth, structure, and physical/chemical properties. The book presents a broad range of techniques, including density functional theory, molecular dynamics, non-equilibrium molecular dynamics, finite element modelling (FEM), numerical modelling and meso-scale modelling. The focus is on each method’s relevance and suitability for the study of materials and phenomena in the nanoscale. This book is an important resource for understanding the mechanisms behind basic properties of nanomaterials, and the major techniques for computational modelling of nanomaterials. Explores the major modelling techniques used for different classes of nanomaterial Assesses the best modelling technique to use for each different type of nanomaterials Discusses the challenges of using certain modelling techniques with specific nanomaterials



Materials Modeling For Macro To Micro Nano Scale Systems


Materials Modeling For Macro To Micro Nano Scale Systems
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Author : Satya Bir Singh
language : en
Publisher:
Release Date : 2022

Materials Modeling For Macro To Micro Nano Scale Systems written by Satya Bir Singh and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2022 with categories.


This new volume offers a state-of-the-art report on various recent scientific developments in the theory of engineering materials. It addresses the close connection between modeling and experimental methods for studying a wide range of nanomaterials and nanostructures.Focusing on practical applications and industry needs, and supported by a solid outlining of theoretical background, the volume provides an overview of approaches that have been developed for designing nanostructured materials. It also covers several aspects of the simulation and design of nanomaterials, analyzed by a selected group of active researchers in the field. The volume also looks at how the advancement of computational tools have enabled nanoscopic prediction of physical and chemical properties and how they can be used to simulate and analyze nanostructures.Materials Modeling for Macro to Micro/Nano Scale Systems is addressed to a wide readership and will be useful for undergraduate and graduate students and as a reference source for professionals including engineers, applied mathematicians, and others working on different application of nanomaterials in engineering.



Materials Modeling For Macro To Micro Nano Scale Systems


Materials Modeling For Macro To Micro Nano Scale Systems
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Author : Satya Bir Singh
language : en
Publisher: CRC Press
Release Date : 2022-06-16

Materials Modeling For Macro To Micro Nano Scale Systems written by Satya Bir Singh and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2022-06-16 with Science categories.


This new volume offers a state-of-the-art report on various recent scientific developments in the theory of engineering materials. It addresses the close connection between modeling and experimental methods for studying a wide range of nanomaterials and nanostructures.Focusing on practical applications and industry needs, and supported by a solid outlining of theoretical background, the volume provides an overview of approaches that have been developed for designing nanostructured materials. It also covers several aspects of the simulation and design of nanomaterials, analyzed by a selected group of active researchers in the field. The volume also looks at how the advancement of computational tools have enabled nanoscopic prediction of physical and chemical properties and how they can be used to simulate and analyze nanostructures.Materials Modeling for Macro to Micro/Nano Scale Systems is addressed to a wide readership and will be useful for undergraduate and graduate students and as a reference source for professionals including engineers, applied mathematicians, and others working on different application of nanomaterials in engineering.



Computational Nanotechnology


Computational Nanotechnology
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Author : Sarhan M. Musa
language : en
Publisher: CRC Press
Release Date : 2018-09-03

Computational Nanotechnology written by Sarhan M. Musa and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018-09-03 with Science categories.


Applications of nanotechnology continue to fuel significant innovations in areas ranging from electronics, microcomputing, and biotechnology to medicine, consumer supplies, aerospace, and energy production. As progress in nanoscale science and engineering leads to the continued development of advanced materials and new devices, improved methods of modeling and simulation are required to achieve a more robust quantitative understanding of matter at the nanoscale. Computational Nanotechnology: Modeling and Applications with MATLAB® provides expert insights into current and emerging methods, opportunities, and challenges associated with the computational techniques involved in nanoscale research. Written by, and for, those working in the interdisciplinary fields that comprise nanotechnology—including engineering, physics, chemistry, biology, and medicine—this book covers a broad spectrum of technical information, research ideas, and practical knowledge. It presents an introduction to computational methods in nanotechnology, including a closer look at the theory and modeling of two important nanoscale systems: molecular magnets and semiconductor quantum dots. Topics covered include: Modeling of nanoparticles and complex nano and MEMS systems Theory associated with micromagnetics Surface modeling of thin films Computational techniques used to validate hypotheses that may not be accessible through traditional experimentation Simulation methods for various nanotubes and modeling of carbon nanotube and silicon nanowire transistors In regard to applications of computational nanotechnology in biology, contributors describe tracking of nanoscale structures in cells, effects of various forces on cellular behavior, and use of protein-coated gold nanoparticles to better understand protein-associated nanomaterials. Emphasizing the importance of MATLAB for biological simulations in nanomedicine, this wide-ranging survey of computational nanotechnology concludes by discussing future directions in the field, highlighting the importance of the algorithms, modeling software, and computational tools in the development of efficient nanoscale systems.



Computational Modelling Of Nanoparticles


Computational Modelling Of Nanoparticles
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Author : Stefan T. Bromley
language : en
Publisher: Elsevier
Release Date : 2018-09-12

Computational Modelling Of Nanoparticles written by Stefan T. Bromley and has been published by Elsevier this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018-09-12 with Science categories.


Computational Modelling of Nanoparticles highlights recent advances in the power and versatility of computational modelling, experimental techniques, and how new progress has opened the door to a more detailed and comprehensive understanding of the world of nanomaterials. Nanoparticles, having dimensions of 100 nanometers or less, are increasingly being used in applications in medicine, materials and manufacturing, and energy. Spanning the smallest sub-nanometer nanoclusters to nanocrystals with diameters of 10s of nanometers, this book provides a state-of-the-art overview on how computational modelling can provide, often otherwise unobtainable, insights into nanoparticulate structure and properties. This comprehensive, single resource is ideal for researchers who want to start/improve their nanoparticle modelling efforts, learn what can be (and what cannot) achieved with computational modelling, and understand more clearly the value and details of computational modelling efforts in their area of research. Explores how computational modelling can be successfully applied at the nanoscale level Includes techniques for the computation modelling of different types of nanoclusters, including nanoalloy clusters, fullerines and Ligated and/or solvated nanoclusters Offers complete coverage of the use of computational modelling at the nanoscale, from characterization and processing, to applications



Multifunctional Materials And Modeling


Multifunctional Materials And Modeling
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Author : M. A. Korepanov
language : en
Publisher: CRC Press
Release Date : 2015-06-10

Multifunctional Materials And Modeling written by M. A. Korepanov and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2015-06-10 with Science categories.


This important book presents a valuable collection of new research and new trends in nanomaterials, mesoscopy, quantum chemistry, and chemical physics processes. It highlights the development of nanomaterials as well as investigation of combustion and explosion processes. It highlights new trends in processes and methods of the treatment of polymeric materials and also covers material modification, including super small quantities of metal/carbon nanocomposites as well as new information on the modeling of processes and quantum calculations. Nonlinear kinetic appearances and their applications are highlighted as well. The chapters are divided into three major sections: computational modeling, surface and interface investigations, and nanochemistry, nanomaterials, and nanostructured materials.



Computational Finite Element Methods In Nanotechnology


Computational Finite Element Methods In Nanotechnology
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Author : Sarhan M. Musa
language : en
Publisher: CRC Press
Release Date : 2017-12-19

Computational Finite Element Methods In Nanotechnology written by Sarhan M. Musa and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2017-12-19 with Science categories.


Computational Finite Element Methods in Nanotechnology demonstrates the capabilities of finite element methods in nanotechnology for a range of fields. Bringing together contributions from researchers around the world, it covers key concepts as well as cutting-edge research and applications to inspire new developments and future interdisciplinary research. In particular, it emphasizes the importance of finite element methods (FEMs) for computational tools in the development of efficient nanoscale systems. The book explores a variety of topics, including: A novel FE-based thermo-electrical-mechanical-coupled model to study mechanical stress, temperature, and electric fields in nano- and microelectronics The integration of distributed element, lumped element, and system-level methods for the design, modeling, and simulation of nano- and micro-electromechanical systems (N/MEMS) Challenges in the simulation of nanorobotic systems and macro-dimensions The simulation of structures and processes such as dislocations, growth of epitaxial films, and precipitation Modeling of self-positioning nanostructures, nanocomposites, and carbon nanotubes and their composites Progress in using FEM to analyze the electric field formed in needleless electrospinning How molecular dynamic (MD) simulations can be integrated into the FEM Applications of finite element analysis in nanomaterials and systems used in medicine, dentistry, biotechnology, and other areas The book includes numerous examples and case studies, as well as recent applications of microscale and nanoscale modeling systems with FEMs using COMSOL Multiphysics® and MATLAB®. A one-stop reference for professionals, researchers, and students, this is also an accessible introduction to computational FEMs in nanotechnology for those new to the field.



Modelling And Mechanics Of Carbon Based Nanostructured Materials


Modelling And Mechanics Of Carbon Based Nanostructured Materials
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Author : Duangkamon Baowan
language : en
Publisher: William Andrew
Release Date : 2017-02-12

Modelling And Mechanics Of Carbon Based Nanostructured Materials written by Duangkamon Baowan and has been published by William Andrew this book supported file pdf, txt, epub, kindle and other format this book has been release on 2017-02-12 with Science categories.


Modelling and Mechanics of Carbon-based Nanostructured Materials sets out the principles of applied mathematical modeling in the topical area of nanotechnology. It is purposely designed to be self-contained, giving readers all the necessary modeling principles required for working with nanostructures. The unique physical properties observed at the nanoscale are often counterintuitive, sometimes astounding researchers and thus driving numerous investigations into their special properties and potential applications. Typically, existing research has been conducted through experimental studies and molecular dynamics simulations. This book goes beyond that to provide new avenues for study and review. Explores how modeling and mechanical principles are applied to better understand the behavior of carbon nanomaterials Clearly explains important models, such as the Lennard-Jones potential, in a carbon nanomaterials context Includes worked examples and exercises to help readers reinforce what they have read