Modeling and Prediction of Polymer Nanocomposite Properties

Discover an authoritative overview of zero-, one-, and two-dimensional polymer nanomaterials  Polymer Nanocomposite Materials: Applications in Integrated Electronic Devices  delivers an original and insightful treatment of polymer nanocomposite applications in energy, information, and biotechnology. The book systematically reviews the preparation and characterization of polymer nanocomposites from zero-, one-, and two-dimensional nanomaterials.  The two distinguished editors have selected resources that thoroughly explore the applications of polymer nanocomposites in energy, information, and biotechnology devices like sensors, solar cells, data storage devices, and artificial synapses. Academic researchers and professional developers alike will enjoy one of the first books on the subject of this environmentally friendly and versatile new technology.  Polymer Nanocomposite Materials  discusses challenges associated with the devices and materials, possible strategies for future directions of the technology, and the possible commercial applications of electronic devices built on these materials. Readers will also benefit from the inclusion of:  A thorough introduction to the fabrication of conductive polymer composites and their applications in sensors An exploration of biodegradable polymer nanocomposites for electronics and polymer nanocomposites for photodetectors Practical discussions of polymer nanocomposites for pressure sensors and the application of polymer nanocomposites in energy storage devices An examination of functional polymer nanocomposites for triboelectric nanogenerators and resistive switching memory Perfect for materials scientists and polymer chemists, Polymer Nanocomposite Materials: Applications in Integrated Electronic Devices will also earn a place in the libraries of sensor developers, electrical engineers, and other professionals working in the sensor industry seeking an authoritative one-stop reference for nanocomposite applications.

The first book to extensively cover nanoparticles, this addresses some of the key issues in nanocomposites. Polymer nanocomposites (polymers reinforced with nanoparticles), are of great interest due to their remarkable mechanical, thermal, chemical properties as well as optical, electronic, and magnetic applications Potential applications include automobile body parts, high-barrier packaging materials, flame-retardants, scratch-resistant composites, and biodegradable nanocomposites Combines basic theory as well as advanced and in-depth knowledge of these properties Broad audience includes researchers in Materials Science, Physics, Polymer Chemistry, and Engineering, and those in industry

Molecular modeling encompasses applied theoretical approaches and computational techniques to model structures and properties of molecular compounds and materials in order to predict and / or interpret their properties. The modeling covered in this book ranges from methods for small chemical to large biological molecules and materials. With its comprehensive coverage of important research fields in molecular and materials science, this is a must-have for all organic, inorganic and biochemists as well as materials scientists interested in applied theoretical and computational chemistry. The 28 chapters, written by an international group of experienced theoretically oriented chemists, are grouped into four parts: Theory and Concepts; Applications in Homogeneous Catalysis; Applications in Pharmaceutical and Biological Chemistry; and Applications in Main Group, Organic and Organometallic Chemistry. The various chapters include concept papers, tutorials, and research reports.

Since the publication of the successful first edition of the book in 2010, the field has matured and a large number of advancements have been made to the science of polymer nanotube nanocomposites (PNT) in terms of synthesis, filler surface modification, as well as properties. Moreover, a number of commercial applications have been realized. The aim of this second volume of the book is, thus, to update the information presented in the first volume as well as to incorporate the recent research and industrial developments. This edited volume brings together contributions from a variety of senior scientists in the field of polymer nanotube composites technology to shed light on the recent advances in these commercially important areas of polymer technology. The book provides the following features: Reviews the various synthesis techniques, properties and applications of the polymer nanocomposite systems Describes the functionalization strategies for single walled nanotubes in order to achieve their nanoscale dispersion in epoxy matrices Provides insights into the multiscale modeling of the properties of PNT Provides perspectives on the electron microscopy characterization of PNT Presents an overview of the different methodologies to achieve micro-patterning of PNT Describes the recent progress on hybridization modifications of CNTs with carbon nanomaterials and their further applications in polymer nanocomposites Provides details on the foams generates with PNT Provides information on synthesis and properties of polycarbonate nanocomposite. Describes the advanced microscopy techniques for understanding of the polymer/nanotube composite interfaces and properties.

The accessible compendium of polymers in carbon nanotubes (CNTs) Carbon nanotubes (CNTs)—extremely thin tubes only a few nanometers in diameter but able to attain lengths thousands of times greater—are prime candidates for use in the development of polymer composite materials. Bringing together thousands of disparate research works, Carbon Nanotube-Polymer Composites: Manufacture, Properties, and Applications covers CNT-polymers from synthesis to potential applications, presenting the basic science and engineering of this dynamic and complex area in an accessible, readable way. Designed to be of use to polymer scientists, engineers, chemists, physicists, and materials scientists, the book covers carbon nanotube fundamentals to help polymer experts understand CNTs, and polymer physics to help those in the CNT field, making it an invaluable resource for anyone working with CNT-polymer composites. Detailed chapters describe the mechanical, rheological, electrical, and thermal properties of carbon nanotube-polymer composites. Including a glossary that defines key terms, Carbon Nanotube-Polymer Composites is essential reading for anyone looking to gain a fundamental understanding of CNTs and polymers, as well as potential and current applications, including electronics (shielding and transparent electrodes), flame retardants, and electromechanics (sensors and actuators), and their challenges.

Written by an expert in the field of nanomaterials, composites, and polymers, this book provides up-to-date information on recent advances in various aspects of polymer composites reinforced by carbonaceous nanofillers, including their fabrication and their electrical, thermal, and mechanical properties. It also extensively covers applications of these nanocomposites in fuel cells, sensors, electromagnetic interference shielding, human implants and scaffolds.

These proceedings are designed to provide a forum that integrates research in characterization and modeling to advance the science of ceramic/composite sintering. Densification, shape deformation, and microstructure evolution during sintering is addressed.

The growing flood of new experimental data generated by genome sequencing has provided an impetus for the development of automated methods for predicting the functions of proteins that have been deduced by sequence analysis and lack experimental characterization. Prediction of Protein Structures, Functions and Interactions presents a comprehensive overview of methods for prediction of protein structure or function, with the emphasis on their availability and possibilities for their combined use. Methods of modeling of individual proteins, prediction of their interactions, and docking of complexes are put in the context of predicting gene ontology (biological process, molecular function, and cellular component) and discussed in the light of their contribution to the emerging field of systems biology. Topics covered include: first steps of protein sequence analysis and structure prediction automated prediction of protein function from sequence template-based prediction of three-dimensional protein structures: fold-recognition and comparative modelling template-free prediction of three-dimensional protein structures quality assessment of protein models prediction of molecular interactions: from small ligands to large protein complexes macromolecular docking integrating prediction of structure, function, and interactions Prediction of Protein Structures, Functions and Interactions focuses on the methods that have performed well in CASPs, and which are constantly developed and maintained, and are freely available to academic researchers either as web servers or programs for local installation. It is an essential guide to the newest, best methods for prediction of protein structure and functions, for researchers and advanced students working in structural bioinformatics, protein chemistry, structural biology and drug discovery.

Mechanical and Dynamic Properties of Biocomposites A comprehensive review of the properties of biocomposites and their applications Mechanical and Dynamic Properties of Biocomposites offers a comprehensive overview of the mechanical and dynamic properties of biocomposites and natural fiber-reinforced polymer composites. This essential resource helps with materials selection in the development of products in the fields of automotive and aerospace engineering as well as the construction of structures in civil engineering.With contributions from a panel of experts in the field, the book reviews the mechanical and damping properties of lingo-cellulosic fibers and their composites. The authors highlight the factors that contribute to the improved properties and their advancements in modern industrialization.Besides, the book is designed to (a) introduce the mechanical and damping properties of lingo-cellulosic fibers and their composites, (b) factors that contribute to improvement in properties such as hybridization, chemical treatment of natural fibers, additive or fillers, etc. and (c) the real-time applications with case studies and future prospects.Key features:Presents viable alternatives to conventional compositesExamines the environmentally friendly and favorable mechanical properties of biocompositesReviews the potential applications of biocomposites in the fields of automotive, mechanical and civil engineeringBrings together in one comprehensive resource information found scattered across the professional literatureWritten for materials scientists, polymer chemists, chemists in industry, civil engineers, construction engineers, and engineering scientists in industry, Mechanical and Dynamic Properties of BIocomposites offers a compreshensive review of the properties and applications of biocomposites.