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Modeling of Carbon and Inorganic Nanotubes and Nanostructures
May 13, 2009 to May 15, 2009
Location : CECAM-HQ-EPFL, Lausanne, Switzerland
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- Quantum Transport in Carbon Nanostructures including Defects
Jean-Christophe Charlier - Modifying physical properties of carbon nanostructures by chemical functionalization
Savas Berber, Ali Zerenturk, Dogan Erbahar - Irradiation of carbon nanomaterials with electrons and ions: from defects to self-organization
Arkady Krasheninnikov - Defects in nanotubes: Blessing and curse
David Tomanek - Carbon Nanotubes and Grapheme Nanoribbons: Screened Hybrid Theoretical Studies
Gustavo Scuseria - First-principles investigations on the functionalization of ZnO nanowires and nanotubes
Andreia Luisa da Rosa, Thomas Frauenheim - Carbon Nanostructures for Energy and Environmental Application
Marco Buongiorno Nardelli - A new energetic regime for carbon nanostructures: the bi-ribbon, and also incommensurate stacking in graphenic bi-layers and graphene as a bi-continuum
Vincent Crespi, D. Stojkovic, P. Zhang, C. Nisoli, P. Lammert, Y. Tang - Non-covalent interactions of porphyrins and carbon nanoclusters
Vladimir Basiuk (Bassiouk Evdokimenko), Oscar Amelines-Sarria, Yevgeniy Kolokoltsev, and Maria Bassiouk - Pillared Graphene: A Novel Nanostructured Material with Enhanced Hydrogen Storage Capacity
Georgios Froudakis - Quantum mechanical modelling of crystals and molecules encapsulated within single walled nanotubes.
Jennifer Green, Emma Sceats, Navaratnarajah Kuganathan - Electronic response properties in organic nanotubes
Daniel Sebastiani - The Growth and Structure Inorganic Nanotubes from Computer Simulation
Mark wilson - Development and applications of a reactive force field (ReaxFF) for surface catalysis
Adri van Duin, Jonathan Mueller, Kimberly Chenoweth, Mike Russo, David Raymand, Kersti Hermannson and Bill Goddard - HRTEM and modeling of closed-cage structures: imaging the atomic scale
Maya Bar-Sadan - Electron transport between graphene layers connected by nanotubes
Pablo Ordejon, Frederico D. Novaes and Riccardo Rurali - Simulation of the Chemical Modification of Carbon Nanotubes
Holger F. Bettinger, Tapas Kar - Construction and Analysis of Carbon Nanotube Structures: Shapes and Ripples
Santiago Melchor, Francisco J. Martin-Martinez, Jose A. Dobado - Quasi-graphite: a new carbon-based structure
Risto Nieminen, T. Vehviläinen, M. Ganchenkova - Structural characteristics of the fulleranes and related main group nanostructures
Mikko Linnolahti, Antti J. Karttunen, Jukka T. Tanskanen, Tapani A. Pakkanen - Car-Parrinello molecular dynamics of inorganic gas molecules and graphene system with Rh intermediation
Sara Furlan, Paolo Giannozzi - Single-molecule detection based on carbon nanotube sensors
Jean-Christophe Charlier - Quantum confinement and electronic properties of single-crystalline silicon nanotubes
Binghai Yan, Gang Zhou, Wenhui Duan, Xiaocheng Zeng, Bingling Gu
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