Multiscale modeling [electronic resource] : from atoms to devices / editors, Pedro Derosa and Tahir Cagin.
Contributor(s): Derosa, Pedro | Cagin, Tahir.
Material type: BookPublisher: Boca Raton : Taylor & Francis, 2010Description: xiv, 271 p. : ill. (some col.).ISBN: 9781439810408 (ebook : PDF).Subject(s): Nanostructured materials -- Computer simulation | Nanotechnology -- Data processing | Multiscale modeling | Multiscale modelingGenre/Form: Electronic books.Additional physical formats: No titleOnline resources: Distributed by publisher. Purchase or institutional license may be required for access. Also available in print edition."A CRC title."
Includes bibliographical references and index.
ch. 1. Overcoming large time- and length-scale challenges in molecular modeling : a review of atomistic to mesoscale coarse-graining methods / Timothy Morrow -- ch. 2. Coarse-graining parameterization and multiscale simulation of hierarchical systems : part 1 : theory and model formulation / Steve Cranford and Markus J. Buehler -- ch. 3. Coarse-graining parameterization and multiscale simulation of hierarchical systems : part 2 : case studies / Steve Cranford and Markus J. Buehler -- ch. 4. Coarse molecular-dynamics analysis of structural transitions in solid materials / Dimitrios Maroudas, Miguel A. Amat and Ioannis G. Kevrekidis -- ch. 5. Multiscale modeling approach for studying MDH-catalyzed methanal oxidation / Nirmal Kumar Reddy Dandala, A.P.J. Jansen and Daniela Silvia Mainardi -- ch. 6. First-principles alloy thermodynamics / Axel van de Walle -- ch. 7. Nonlinear finite element model for the determination of elastic and thermal properties of nanocomposites / Paul Elsbernd and Pol Spanos -- ch. 8. Ensemble Monte Carlo device modeling : high-field transport in nitrides / Cem Sevik -- ch. 9. Modeling two-dimensional charge devices / Afif Siddiki.
Also available in print edition.
Mode of access: World Wide Web.
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