Molecular Modeling Of Functional Material Interfaces
Download Molecular Modeling Of Functional Material Interfaces full books in PDF, epub, and Kindle. Read online free Molecular Modeling Of Functional Material Interfaces ebook anywhere anytime directly on your device. Fast Download speed and no annoying ads. We cannot guarantee that every ebooks is available!
Applying Molecular and Materials Modeling
| Author | : Phillip R. Westmoreland |
| Publisher | : Springer Science & Business Media |
| Total Pages | : 596 |
| Release | : 2013-04-17 |
| Genre | : Science |
| ISBN | : 9401707650 |
Computational molecular and materials modeling has emerged to deliver solid technological impacts in the chemical, pharmaceutical, and materials industries. It is not the all-predictive science fiction that discouraged early adopters in the 1980s. Rather, it is proving a valuable aid to designing and developing new products and processes. People create, not computers, and these tools give them qualitative relations and quantitative properties that they need to make creative decisions. With detailed analysis and examples from around the world, Applying Molecular and Materials Modeling describes the science, applications, and infrastructures that have proven successful. Computational quantum chemistry, molecular simulations, informatics, desktop graphics, and high-performance computing all play important roles. At the same time, the best technology requires the right practitioners, the right organizational structures, and - most of all - a clearly understood blend of imagination and realism that propels technological advances. This book is itself a powerful tool to help scientists, engineers, and managers understand and take advantage of these advances.
Chemistry of Functional Materials Surfaces and Interfaces
| Author | : Andrei Honciuc |
| Publisher | : Elsevier |
| Total Pages | : 282 |
| Release | : 2021-02-19 |
| Genre | : Science |
| ISBN | : 0128231939 |
Chemistry of Functional Materials Surfaces and Interfaces: Fundamentals and Applications gives a descriptive account of interfacial phenomena step-by-step, from simple to complex, to provide readers with a strong foundation of knowledge in interfacial materials chemistry. Many case studies are provided to give real-world examples of problems and their solutions, allowing readers to make the connection between fundamental understanding and applications. Emerging applications in nanomaterials and nanotechnology are also discussed. Throughout the book, the author explains the common interface and surface equations, models, methods, and applications in the creation of functional materials. The goal of Chemistry of Functional Materials Surfaces and Interfaces is to provide readers with the basic understanding of the common tools of surface and interface chemistry for application in materials science and nanotechnology. This book is suitable for researchers and practitioners in the disciplines of materials science and engineering and surface and interface chemistry. Includes numerous real-world examples and case studies throughout Addresses emerging applications of interfacial materials chemistry in nanomaterials and nanotechnology Provides the foundational concepts of surface and interfacial science with models, equation, and methods
Molecular Materials with Specific Interactions - Modeling and Design
| Author | : W. Andrzej Sokalski |
| Publisher | : Springer Science & Business Media |
| Total Pages | : 597 |
| Release | : 2007-05-06 |
| Genre | : Science |
| ISBN | : 140205372X |
Design of new molecular materials is emerging as a new interdisciplinary research field. Corresponding reports are scattered in literature, and this book constitutes one of the first attempts to overview ongoing research efforts. It provides basic information, as well as the details of theory and examples of its application, to experimentalists and theoreticians interested in modeling molecular properties and putting into practice rational design of new materials.
Molecular Modeling and Multiscaling Issues for Electronic Material Applications
| Author | : Artur Wymyslowski |
| Publisher | : Springer |
| Total Pages | : 203 |
| Release | : 2014-11-20 |
| Genre | : Technology & Engineering |
| ISBN | : 3319128620 |
This book offers readers a snapshot of the progression of molecular modeling in the electronics industry and how molecular modeling is currently being used to understand materials to solve relevant issues in this field. The reader is introduced to the evolving role of molecular modeling, especially seen from the perspective of the IEEE community and modeling in electronics. This book also covers the aspects of molecular modeling needed to understand the relationship between structures and mechanical performance of materials. The authors also discuss the transitional topic of multiscale modeling and recent developments on the atomistic scale and current attempts to reach the submicron scale, as well as the role that quantum mechanics can play in performance prediction.
Hybrid Organic-Inorganic Interfaces
| Author | : Marie Helene Delville |
| Publisher | : John Wiley & Sons |
| Total Pages | : 1010 |
| Release | : 2018-04-09 |
| Genre | : Technology & Engineering |
| ISBN | : 3527342559 |
Das erste Handbuch und gut zugängliche Referenzwerk zu diesem zunehmend wichtigen Thema erläutert in einem anwendungsorientierten Ansatz Synthese, Design, Charakterisierung und Simulation von Grenzflächen bei hybriden organisch-anorganischen Materialien.
Chemical Modelling
| Author | : Michael Springborg |
| Publisher | : Royal Society of Chemistry |
| Total Pages | : 196 |
| Release | : 2021-04-14 |
| Genre | : Science |
| ISBN | : 1839162651 |
Chemical modelling covers a wide range of disciplines and this book is the first stop for any materials scientist, biochemist, chemist or molecular physicist wishing to acquaint themselves with major developments in the applications and theory of chemical modelling. Containing both comprehensive and critical reviews, it is a convenient reference to the current literature. Coverage includes, but is not limited to, isomerism in polyoxometalate chemistry, modelling molecular magnets, molecular modelling of cyclodextrin inclusion complexes and graphene nanoribbons heterojunctions.
Beyond the Molecular Frontier
| Author | : National Research Council |
| Publisher | : National Academies Press |
| Total Pages | : 238 |
| Release | : 2003-03-19 |
| Genre | : Science |
| ISBN | : 0309168392 |
Chemistry and chemical engineering have changed significantly in the last decade. They have broadened their scopeâ€"into biology, nanotechnology, materials science, computation, and advanced methods of process systems engineering and controlâ€"so much that the programs in most chemistry and chemical engineering departments now barely resemble the classical notion of chemistry. Beyond the Molecular Frontier brings together research, discovery, and invention across the entire spectrum of the chemical sciencesâ€"from fundamental, molecular-level chemistry to large-scale chemical processing technology. This reflects the way the field has evolved, the synergy at universities between research and education in chemistry and chemical engineering, and the way chemists and chemical engineers work together in industry. The astonishing developments in science and engineering during the 20th century have made it possible to dream of new goals that might previously have been considered unthinkable. This book identifies the key opportunities and challenges for the chemical sciences, from basic research to societal needs and from terrorism defense to environmental protection, and it looks at the ways in which chemists and chemical engineers can work together to contribute to an improved future.
Handbook of Surfaces and Interfaces of Materials, Five-Volume Set
| Author | : Hari Singh Nalwa |
| Publisher | : Elsevier |
| Total Pages | : 1915 |
| Release | : 2001-10-26 |
| Genre | : Technology & Engineering |
| ISBN | : 0080533825 |
This handbook brings together, under a single cover, all aspects of the chemistry, physics, and engineering of surfaces and interfaces of materials currently studied in academic and industrial research. It covers different experimental and theoretical aspects of surfaces and interfaces, their physical properties, and spectroscopic techniques that have been applied to a wide class of inorganic, organic, polymer, and biological materials. The diversified technological areas of surface science reflect the explosion of scientific information on surfaces and interfaces of materials and their spectroscopic characterization. The large volume of experimental data on chemistry, physics, and engineering aspects of materials surfaces and interfaces remains scattered in so many different periodicals, therefore this handbook compilation is needed.The information presented in this multivolume reference draws on two decades of pioneering research on the surfaces and interfaces of materials to offer a complete perspective on the topic. These five volumes-Surface and Interface Phenomena; Surface Characterization and Properties; Nanostructures, Micelles, and Colloids; Thin Films and Layers; Biointerfaces and Applications-provide multidisciplinary review chapters and summarize the current status of the field covering important scientific and technological developments made over past decades in surfaces and interfaces of materials and spectroscopic techniques with contributions from internationally recognized experts from all over the world. Fully cross-referenced, this book has clear, precise, and wide appeal as an essential reference source long due for the scientific community. The complete reference on the topic of surfaces and interfaces of materialsThe information presented in this multivolume reference draws on two decades of pioneering researchProvides multidisciplinary review chapters and summarizes the current status of the fieldCovers important scientific and technological developments made over past decades in surfaces and interfaces of materials and spectroscopic techniquesContributions from internationally recognized experts from all over the world
Foundations of Molecular Modeling and Simulation
| Author | : Randall Q Snurr |
| Publisher | : Springer |
| Total Pages | : 176 |
| Release | : 2016-06-01 |
| Genre | : Technology & Engineering |
| ISBN | : 9811011281 |
This book is a collection of select proceedings of the FOMMS 2015 conference. FOMMS 2015 was the sixth triennial FOMMS conference showcasing applications of theory of computational quantum chemistry, molecular science, and engineering simulation. The theme of the 2015 meeting was on Molecular Modeling and the Materials Genome. This volume comprises chapters on many distinct applications of molecular modeling techniques. The content will be useful to researchers and students alike.
