 | Nanotech 2007 Vol. 1
Technical Proceedings of the 2007 NSTI Nanotechnology Conference and Trade Show, Volume 1
Chapter 6: Nanoscale Modeling |
| - | Influence of His-195 on the nitrogenase FeMo-cofactor activity |
| | C. Cavallotti, D. Moscatelli and S. Carrà |
| | Politecnico di Milano, IT |
| - | Denaturation of hen egg white lysozyme in electromagnetic fields: a molecular dynamics study |
| | N.J. English and D.A. Mooney |
| | University College Dublin, IE |
| - | Investigation of dsDNA Molecule Mechanical Behavior using Atomistic Continuum Mechanics Method |
| | C-N Han, C-Y Chou, C-J Wu and K-N Chiang |
| | Advanced Microsystem Packaging and Nano-Mechanics Research Laboratory, National Tsing Hua University, TW |
| - | Theoretical Studies on the Ozonization at the Capped-end of a Single-walled Carbon Nanotube: The Effect of the Finite Length |
| | M. Sawangphruk, J. Sirijaraensre, P. Pantu and J. Limtrakul |
| | Kasetsart University, TH |
| - | Structure and Electronic Properties of “DNA-Gold-Nanotube” Systems: A Quantum Chemical Analysis |
| | P. Pannopard, J. Sirijaraensre, S. Nokbin, P. Khongpracha and J. Limtrakul |
| | Kasetsart University, TH |
| - | Molecular Dynamic investigation of the interaction of supported affinity ligands with Monoclonal Antibodies |
| | L. Zamolo, V. Busini, D. Moiani, D. Moscatelli and C. Cavallotti |
| | Politecnico di Milano, IT |
| - | Adsorption of glycine and phenylalanine in H-ZSM-5 zeolite: an embedded QM/MM study |
| | B. Boekfa, J. Sirijaraensre, P. Limtrakul, P. Pantu and J. Limtrakul |
| | Kasetsart University, TH |
| - | Scanning Tunneling Microscopy Images of Au Adsorbed on GaAs(111)B surface |
| | H. Yi, P. Kratzer, E. Hilner and A. Mikkelsen |
| | KISTI, KR |
| - | New Pair Force Evaluation Method for Parallel Molecular Dynamics in Arbitrary Geometries |
| | G.B. Macpherson and J.M. Reese |
| | University of Strathclyde, UK |
| - | Electric Filed Modulation on the Geometric and Electronic Structures of Diblock Molecule |
| | Y. Wi Li, G.P. Yin and J.W. Zhao |
| | Harbin Institute of Technology, CN |
| - | Nonequilibrium molecular dynamics simulation for size effects on thermal conductivity of silicon nanostructures |
| | X.J. Liu, Y.W. Yang and J.P. Yang |
| | Nanyang Technological University, SG |
| - | Deformation of Carbon Nanotube Oscillators Encapsulating Cu Nanowires |
| | J.H. Lee, J.W. Kang and H.J. Hwang |
| | Sangmyung University, KR |
| - | Molecular Dynamics Simulations of Nonvolatile Carbon Nanotube Shuttle Memory |
| | O.K. Kwon, J.H. Lee, J.W. Kang and H.J. Hwang |
| | Semyung University, KR |
| - | The Innitial Reverse-Bias Injecting P+-N Junction Mode in P+-N-P+- Structures with Punch-Through |
| | I. Mats |
| | Diatex, Selected Texno-Fix, CA |
| - | Computational Screening of Metallofullerenes for Nanoscience |
| | Z. Slanina and S. Nagase |
| | Institute for Molecular Science, JP |
| - | Efficient DSMC Modeling Techniques for Micro/Nano Gas Flows |
| | N. Masters and W. Ye |
| | Georgia Institute of Technology, US |
| - | Investigation of Mechanical Strength of the Nanoshell of Bacteriophage Phi-29 |
| | C-N Han, C-Y Chou and K-N Chiang |
| | National Tsing Hua University, Taiwan, TW |
| - | Quantum Design of Complex Nanostructured Electronic Materials |
| | A.J. Williamson |
| | Lawrence Livermore National Laboratory, US |
| - | Pseudopotential theory of electronic excitations in semiconductor nanostructures |
| | A. Franceschetti and M.C. Troparevsky |
| | National Renewable Energy Laboratory, US |
| - | Conduction Properties of BN-doped Fullerene Chain Obtained by Density Functional Calculations |
| | N. Krainara, P. Luksirikul, J. Sirijaraensre, P. Pantu and J. Limtrakul |
| | Kasetsart University, TH |
| - | Atomistic Simulation of Cracktip Failure Pathways in Fe and Fe Alloys |
| | P.A. Gordon, T. Neeraj, Y. Li and M.J. Luton |
| | ExxonMobil Research & Engineering, US |
| - | Dielectric Response in Silicon Nanostructures from first principles |
| | S. Hamel, A. Williamson, H. Wilson, F. Gygi, G. Galli, E. Ratner and D. Wack |
| | Lawrence Livermore National Laboratory, US |
| - | A Temperature-related Homogenization Technique for Nanoscale Continuum Approximation |
| | S.P. Xiao and W.X. Yang |
| | The University of Iowa, US |
| - | Mechanics of silicon nanowires: size-dependent elasticity from first principles |
| | R.E. Rudd and B. Lee |
| | Lawrence Livermore National Laboratory, US |
| - | Molecular Simulation and Theory for Nanosystems |
| | R.J. Sadus |
| | Swinburne University of Technology, AU |
| - | Interaction of DNA with Single-Walled Carbon Nanotubes: Implication to the Bio-Sensors |
| | K-J Kong, H. Chang and J-O Lee |
| | Korea Research Institute of Chemical Technology, KR |
| - | A Kinetic Study of the MOCVD of GaN |
| | D. Moscatelli and C. Cavallotti |
| | Politecnico di Milano, IT |
| - | A Multiscale investigation of the influence of surface morphology on thin films CVD deposition |
| | A. Barbato, M. Rondanini and C. Cavallotti |
| | Politecnico di Milano, IT |
| - | Bridging Domain Multiscale Method |
| | S.P. Xiao and W.Y. Hou |
| | The University of Iowa, US |
| - | Atomistic-Continuum Simulations of Carbon Nanotubes in LIquids |
| | P. Koumoutsakos, E. Kotsalis, J.H. Walther and A. Dupuis |
| | ETH Zurich, CH |
| - | Influence of His-195 on the nitrogenase FeMo-cofactor activity |
| | C. Cavallotti, D. Moscatelli and S. Carrà |
| | Politecnico di Milano, IT |
| - | Denaturation of hen egg white lysozyme in electromagnetic fields: a molecular dynamics study |
| | N.J. English and D.A. Mooney |
| | University College Dublin, IE |
| - | Investigation of dsDNA Molecule Mechanical Behavior using Atomistic Continuum Mechanics Method |
| | C-N Han, C-Y Chou, C-J Wu and K-N Chiang |
| | Advanced Microsystem Packaging and Nano-Mechanics Research Laboratory, National Tsing Hua University, TW |
| - | Theoretical Studies on the Ozonization at the Capped-end of a Single-walled Carbon Nanotube: The Effect of the Finite Length |
| | M. Sawangphruk, J. Sirijaraensre, P. Pantu and J. Limtrakul |
| | Kasetsart University, TH |
| - | Structure and Electronic Properties of “DNA-Gold-Nanotube” Systems: A Quantum Chemical Analysis |
| | P. Pannopard, J. Sirijaraensre, S. Nokbin, P. Khongpracha and J. Limtrakul |
| | Kasetsart University, TH |
| - | Molecular Dynamic investigation of the interaction of supported affinity ligands with Monoclonal Antibodies |
| | L. Zamolo, V. Busini, D. Moiani, D. Moscatelli and C. Cavallotti |
| | Politecnico di Milano, IT |
| - | Adsorption of glycine and phenylalanine in H-ZSM-5 zeolite: an embedded QM/MM study |
| | B. Boekfa, J. Sirijaraensre, P. Limtrakul, P. Pantu and J. Limtrakul |
| | Kasetsart University, TH |
| - | Scanning Tunneling Microscopy Images of Au Adsorbed on GaAs(111)B surface |
| | H. Yi, P. Kratzer, E. Hilner and A. Mikkelsen |
| | KISTI, KR |
| - | New Pair Force Evaluation Method for Parallel Molecular Dynamics in Arbitrary Geometries |
| | G.B. Macpherson and J.M. Reese |
| | University of Strathclyde, UK |
| - | Electric Filed Modulation on the Geometric and Electronic Structures of Diblock Molecule |
| | Y. Wi Li, G.P. Yin and J.W. Zhao |
| | Harbin Institute of Technology, CN |
| - | Nonequilibrium molecular dynamics simulation for size effects on thermal conductivity of silicon nanostructures |
| | X.J. Liu, Y.W. Yang and J.P. Yang |
| | Nanyang Technological University, SG |
| - | Deformation of Carbon Nanotube Oscillators Encapsulating Cu Nanowires |
| | J.H. Lee, J.W. Kang and H.J. Hwang |
| | Sangmyung University, KR |
| - | Molecular Dynamics Simulations of Nonvolatile Carbon Nanotube Shuttle Memory |
| | O.K. Kwon, J.H. Lee, J.W. Kang and H.J. Hwang |
| | Semyung University, KR |
| - | The Innitial Reverse-Bias Injecting P+-N Junction Mode in P+-N-P+- Structures with Punch-Through |
| | I. Mats |
| | Diatex, Selected Texno-Fix, CA |
| - | Computational Screening of Metallofullerenes for Nanoscience |
| | Z. Slanina and S. Nagase |
| | Institute for Molecular Science, JP |
| - | Efficient DSMC Modeling Techniques for Micro/Nano Gas Flows |
| | N. Masters and W. Ye |
| | Georgia Institute of Technology, US |
| - | Investigation of Mechanical Strength of the Nanoshell of Bacteriophage Phi-29 |
| | C-N Han, C-Y Chou and K-N Chiang |
| | National Tsing Hua University, Taiwan, TW |
| - | Quantum Design of Complex Nanostructured Electronic Materials |
| | A.J. Williamson |
| | Lawrence Livermore National Laboratory, US |
| - | Pseudopotential theory of electronic excitations in semiconductor nanostructures |
| | A. Franceschetti and M.C. Troparevsky |
| | National Renewable Energy Laboratory, US |
| - | Conduction Properties of BN-doped Fullerene Chain Obtained by Density Functional Calculations |
| | N. Krainara, P. Luksirikul, J. Sirijaraensre, P. Pantu and J. Limtrakul |
| | Kasetsart University, TH |
| - | Atomistic Simulation of Cracktip Failure Pathways in Fe and Fe Alloys |
| | P.A. Gordon, T. Neeraj, Y. Li and M.J. Luton |
| | ExxonMobil Research & Engineering, US |
| - | Dielectric Response in Silicon Nanostructures from first principles |
| | S. Hamel, A. Williamson, H. Wilson, F. Gygi, G. Galli, E. Ratner and D. Wack |
| | Lawrence Livermore National Laboratory, US |
| - | A Temperature-related Homogenization Technique for Nanoscale Continuum Approximation |
| | S.P. Xiao and W.X. Yang |
| | The University of Iowa, US |
| - | Mechanics of silicon nanowires: size-dependent elasticity from first principles |
| | R.E. Rudd and B. Lee |
| | Lawrence Livermore National Laboratory, US |
| - | Molecular Simulation and Theory for Nanosystems |
| | R.J. Sadus |
| | Swinburne University of Technology, AU |
| - | Interaction of DNA with Single-Walled Carbon Nanotubes: Implication to the Bio-Sensors |
| | K-J Kong, H. Chang and J-O Lee |
| | Korea Research Institute of Chemical Technology, KR |
| - | A Kinetic Study of the MOCVD of GaN |
| | D. Moscatelli and C. Cavallotti |
| | Politecnico di Milano, IT |
| - | A Multiscale investigation of the influence of surface morphology on thin films CVD deposition |
| | A. Barbato, M. Rondanini and C. Cavallotti |
| | Politecnico di Milano, IT |
| - | Bridging Domain Multiscale Method |
| | S.P. Xiao and W.Y. Hou |
| | The University of Iowa, US |
| - | Atomistic-Continuum Simulations of Carbon Nanotubes in LIquids |
| | P. Koumoutsakos, E. Kotsalis, J.H. Walther and A. Dupuis |
| | ETH Zurich, CH |
| ISBN: | 1-4200-6182-8 |
| Pages: | 726 |
| Hardcopy: | $199.99 |
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