Nanoscience And Computational Chemistry
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Nanoscience And Computational Chemistry
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Author : Andrew G. Mercader
language : en
Publisher: CRC Press
Release Date : 2013-11-23
Nanoscience And Computational Chemistry written by Andrew G. Mercader and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2013-11-23 with Science categories.
This book provides innovative chapters covering new methodologies and important applications in the fields of nanoscience and computational chemistry. The book offers scope for academics, researchers, and engineering professionals to present their research and development works that have potential for applications in several disciplines of nano and
Nanoscience And Computational Chemistry
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Author : Andrew G. Mercader
language : en
Publisher: CRC Press
Release Date : 2013-11-23
Nanoscience And Computational Chemistry written by Andrew G. Mercader and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2013-11-23 with Science categories.
This book provides innovative chapters covering new methodologies and important applications in the fields of nanoscience and computational chemistry. The book offers scope for academics, researchers, and engineering professionals to present their research and development works that have potential for applications in several disciplines of nano and computational chemistry. Contributions range from new methods to novel applications of existing methods to help readers gain an understanding of the material and/or structural behavior of new and advanced systems. This book is a high quality tool for researchers, providing an overview of the field, explaining the basic underlying theory at a meaningful level, and giving numerous comparisons of different methods.
Nanocomputing
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Author : Jang-Yu Hsu
language : en
Publisher: CRC Press
Release Date : 2017-03-03
Nanocomputing written by Jang-Yu Hsu and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2017-03-03 with Science categories.
This book provides a comprehensive overview of the computational physics for nanoscience and nanotechnology. Based on MATLAB and the C++ distributed computing paradigm, the book gives instructive explanations of the underlying physics for mesoscopic systems with many listed programs that readily compute physical properties into nanoscales. Many generated graphical pictures demonstrate not only the principles of physics, but also the methodology of computing.
Computational Nanoscience
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Author : Kálmán Varga
language : en
Publisher: Cambridge University Press
Release Date : 2011-04-14
Computational Nanoscience written by Kálmán Varga and has been published by Cambridge University Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2011-04-14 with Science categories.
Computer simulation is an indispensable research tool in modeling, understanding and predicting nanoscale phenomena. However, the advanced computer codes used by researchers are too complicated for graduate students wanting to understand computer simulations of physical systems. This book gives students the tools to develop their own codes. Describing advanced algorithms, the book is ideal for students in computational physics, quantum mechanics, atomic and molecular physics, and condensed matter theory. It contains a wide variety of practical examples of varying complexity to help readers at all levels of experience. An algorithm library in Fortran 90, available online at www.cambridge.org/9781107001701, implements the advanced computational approaches described in the text to solve physical problems.
Chemical Nanoscience And Nanotechnology
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Author : Francisco Torrens
language : en
Publisher: CRC Press
Release Date : 2019-08-05
Chemical Nanoscience And Nanotechnology written by Francisco Torrens and has been published by CRC Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2019-08-05 with Technology & Engineering categories.
This new volume presents a wealth of practical experience and research on new methodologies and important applications in chemical nanotechnology. It also includes small-scale nanotechnology-related projects that have potential applications in several disciplines of chemistry and nanotechnology. In this book, contributions range from new methods to novel applications of existing methods to gain understanding of the material and/or structural behavior of new and advanced systems. Topics cover computational methods in chemical engineering and chemoinformatics, studies of some of physico-chemical properties of several important nanoalloy clusters, the use of 3D reconstruction of nanofibrous membranes, nanotechnology research for green engineering and sustainability, nanofiltration and carbon nanotubes applications in water treatment, and much more.
Computational Nanoscience
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Author : Elena Bichoutskaia
language : en
Publisher: Royal Society of Chemistry
Release Date : 2011
Computational Nanoscience written by Elena Bichoutskaia and has been published by Royal Society of Chemistry this book supported file pdf, txt, epub, kindle and other format this book has been release on 2011 with Computers categories.
This comprehensive and up-to-date survey of new developments and applications in computational nanoscience is suitable for theoreticians, researchers and students.
Nanoscience And Advancing Computational Methods In Chemistry Research Progress
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Author : Castro, Eduardo A.
language : en
Publisher: IGI Global
Release Date : 2012-05-31
Nanoscience And Advancing Computational Methods In Chemistry Research Progress written by Castro, Eduardo A. and has been published by IGI Global this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-05-31 with Technology & Engineering categories.
The budding field of nanotechnology offers enormous potential for advances in medical science, engineering, transportation, computers, and many other industries. As this growing field solidifies, these technological advances may soon become a reality. Nanoscience and Advancing Computational Methods in Chemistry: Research Progress provides innovative chapters covering the growth of educational, scientific, and industrial research activities among chemical engineers and provides a medium for mutual communication between international academia and the industry. This book publishes significant research reporting new methodologies and important applications in the fields of chemical informatics and discusses latest coverage of chemical databases and the development of new experimental methods.
Towards Efficient Designing Of Safe Nanomaterials
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Author : Jerzy Leszczynski
language : en
Publisher: Royal Society of Chemistry
Release Date : 2012-09-30
Towards Efficient Designing Of Safe Nanomaterials written by Jerzy Leszczynski and has been published by Royal Society of Chemistry this book supported file pdf, txt, epub, kindle and other format this book has been release on 2012-09-30 with Science categories.
The expanding field of nanotechnology is now one of the most promising areas of science. However, because some nanoparticles can have a negative impact on human health and the environment, the design of novel materials must always be accompanied by a comprehensive risk assessment. Until now, the information on the methods available has been fragmented and incomplete. This book is the first to provide a comprehensive review of recent progress and challenges in the risk assessment of nanomaterials by empirical and computational techniques. Topics covered include: benefits versus risks, carbon based nanomaterials, environmental detection and quantitative analysis, chemometric modelling, human exposure assessment, toxicity testing, nano-QSAR, risk assessment strategies, policy and regulatory frameworks.
Chemistry Of Nanomaterials
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Author : Tahir Iqbal Awan
language : en
Publisher: Elsevier
Release Date : 2020-05-20
Chemistry Of Nanomaterials written by Tahir Iqbal Awan and has been published by Elsevier this book supported file pdf, txt, epub, kindle and other format this book has been release on 2020-05-20 with Science categories.
Chemistry of Nanomaterials: Fundamentals and Applications provides a foundational introduction to this chemistry. Beginning with an introduction to the field of nanoscience and technology, the book goes on to outline a whole range of important effects, interactions and properties. Tools used to assess such properties are discussed, followed by chapters putting this fundamental knowledge in context by providing examples of nanomaterials and their applications in the real world. Drawing on the experience of its expert authors, this book is an accessible introduction to the interactions at play in nanomaterials for both upper-level students and researchers.
Reviews Of Modern Quantum Chemistry
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Author : K. D. Sen
language : en
Publisher: World Scientific
Release Date : 2002
Reviews Of Modern Quantum Chemistry written by K. D. Sen and has been published by World Scientific this book supported file pdf, txt, epub, kindle and other format this book has been release on 2002 with Science categories.
This important book collects together state?of?the?art reviews of diverse topics covering almost all the major areas of modern quantum chemistry. The current focus in the discipline of chemistry ? synthesis, structure, reactivity and dynamics ? is mainly on control. A variety of essential computational tools at the disposal of chemists have emerged from recent studies in quantum chemistry. The acceptance and application of these tools in the interfacial disciplines of the life and physical sciences continue to grow. The new era of modern quantum chemistry throws up promising potentialities for further research.Reviews of Modern Quantum Chemistry is a joint endeavor, in which renowned scientists from leading universities and research laboratories spanning 22 countries present 59 in?depth reviews. Along with a personal introduction written by Professor Walter Kohn, Nobel laureate (Chemistry, 1998), the articles celebrate the scientific contributions of Professor Robert G Parr on the occasion of his 80th birthday.List of Contributors: W Kohn, M Levy, R Pariser, B R Judd, E Lo, B N Plakhutin, A Savin, P Politzer, P Lane, J S Murray, A J Thakkar, S R Gadre, R F Nalewajski, K Jug, M Randic, G Del Re, U Kaldor, E Eliav, A Landau, M Ehara, M Ishida, K Toyota, H Nakatsuji, G Maroulis, A M Mebel, S Mahapatra, R Carb¢?Dorca, ? Nagy, I A Howard, N H March, S?B Liu, R G Pearson, N Watanabe, S Ten?no, S Iwata, Y Udagawa, E Valderrama, X Fradera, I Silanes, J M Ugalde, R J Boyd, E V Lude¤a, V V Karasiev, L Massa, T Tsuneda, K Hirao, J-M Tao, J P Perdew, O V Gritsenko, M Grning, E J Baerends, F Aparicio, J Garza, A Cedillo, M Galv n, R Vargas, E Engel, A Hck, R N Schmid, R M Dreizler, J Poater, M Sol , M Duran, J Robles, X Fradera, P K Chattaraj, A Poddar, B Maiti, A Cedillo, S Gutirrez?Oliva, P Jaque, A Toro?Labb, H Chermette, P Boulet, S Portmann, P Fuentealba, R Contreras, P Geerlings, F De Proft, R Balawender, D P Chong, A Vela, G Merino, F Kootstra, P L de Boeij, R van Leeuwen, J G Snijders, N T Maitra, K Burke, H Appel, E K U Gross, M K Harbola, H F Hameka, C A Daul, I Ciofini, A Bencini, S K Ghosh, A Tachibana, J M Cabrera?Trujillo, F Tenorio, O Mayorga, M Cases, V Kumar, Y Kawazoe, A M Kster, P Calaminici, Z G¢mez, U Reveles, J A Alonso, L M Molina, M J L¢pez, F Dugue, A Ma¤anes, C A Fahlstrom, J A Nichols, D A Dixon, P A Derosa, A G Zacarias, J M Seminario, D G Kanhere, A Vichare, S A Blundell, Z?Y Lu, H?Y Liu, M Elstner, W?T Yang, J Mu¤oz, X Fradera, M Orozco, F J Luque, P Tarakeshwar, H M Lee, K S Kim, M Valiev, E J Bylaska, A Gramada, J H Weare, J Brickmann, M Keil, T E Exner, M Hoffmann & J Rychlewski.