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Trends in Computational Nanomechanics-Transcending Length and Time Scales
I am happy to announce the forthcoming volume titled Trends in Computational Nanomechanics - Transcending Length and Time Scales The volume is an informative description of the progress in nanomechanics as of 2009. It captures the important insights generated via the separate application of microscopic (from ab initio to tight binding to empirical force field) and continuum modeling techniques, as well as recent developments in multiscale methodologies and the new results generated by utilizing these methods.
Content:
Springer Series: Challenges and Advances in Computational Chemistry and Physics, Vol. 9
Dumitrica, Traian (Ed.)
2010, XVIII, 620 p., Hardcover
ISBN: 978-1-4020-9784-3
Chapter 1 Hybrid Quantum/Classical Modeling of Material Systems: The "Learn on the Fly" Molecular Dynamics Scheme
by Gianpietro Moras, Rathin Choudhury, James R. Kermode, Gabor Csányi, Michael C. Payne, and Alessandro de Vita
Chapter 2 Multiscale Molecular Dynamics and the Reverse Mapping Problem
by Bernd Ensing and Steven O. Nielsen
Chapter 3 Transition Path Sampling Studies of Solid-Solid Transformations in Nanocrystals under Pressure
by Michael Grunwald and Christoph Dellago
Chapter 4 Nonequilibrium Molecular Dynamics and Multiscale Modeling of Heat Conduction in Solids
by Simon P.A. Gill
Chapter 5 A Multiscale Methodology to Approach Nanoscale Thermal Transport
by Ishwar K. Puri and Sohail Murad
Chapter 6 Multiscale Modeling of Contact-Induced Plasticity in Nanocrystalline Metals
by Virginie Dupont and Frederic Sansoz
Chapter 7 Silicon Nanowires:From Empirical to First Principles Modeling
by Ricardo W. Nunes and João F. Justo
Chapter 8 Multiscale Modeling of Surface Effects on the Mechanical Behavior and Properties of Nanowires
by Harold S. Park and Patrick A. Klein
Chapter 9 Predicting the Atomic Configuration of 1- and 2-Dimensional Nanostructures via Global Optimization Methods
by C.V. Ciobanu, C.Z. Wang, D.P. Mehta, and K.M. Ho
Chapter 10 Atomic-Scale Simulations of the Mechanical Behavior of Carbon Nanotube Systems
by Byeong-Woo Jeong and Susan B. Sinnott
Chapter 11 Stick-Spiral Modelfor Studying Mechanical Properties of Carbon Nanotubes by Tienchong Chang
Chapter 12 Potentials for van der Waals Interaction in Nano-Scale Computation
by J. Xiao, W. Zhou, Y. Huang, J.M. Zuo, and K.C. Hwang
Chapter 13 Electrical Conduction in Carbon Nanotubes under Mechanical Deformations
by Antonio Pantano
Chapter 14 Multiscale Modeling of Carbon Nanotubes
by Yuzhou Sun and K.M. Liew
Chapter 15 Quasicontinuum Simulations of Deformations of Carbon Nanotube
by Seyoung Im, Sungjin Kwon, and Jong Youn Park
Chapter 16 Electronic Properties and Reactivities of Perfect, Defected, and Doped Single-Walled Carbon Nanotubes
by Wei Quan Tian, Lei Vincent Liu, YaKun Chen, and Yan Alexander Wang
Chapter 17 Multiscale Modeling of Biological Protein Materials - Deformation and Failure
by Sinan Keten, Jeremie Bertaud, Dipanjan Sen, Zhiping Xu, Theodor Ackbarow, and Markus J. Buehler
Chapter 18 Computational Molecular Biomechanics: A Hierarchical Multiscale Framework with Applications to Gating of Mechanosensitive Channels of Large Conductance
by Xi Chen and Qiang Cui
Chapter 19 Out Of Many, One: Modeling Schemes for Biopolymer and Biofibril Networks
by E.A. Sander, A.M. Stein, M.J.Swickrath, and V.H. Barocas
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