Journal of Computational and Theoretical Nanoscience is an international peer-reviewed journal with a wide-ranging coverage, consolidates research activities in all aspects of computational and theoretical nanoscience into a single reference source. This journal offers scientists and engineers peer-reviewed research papers in all aspects of computational and theoretical nanoscience and nanotechnology in chemistry, physics, materials science, engineering and biology to publish original full papers and timely state-of-the-art reviews and short communications encompassing the fundamental and applied research.

Publisher: American Scientific Publishers

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Volume 4, Number 3, May 2007

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Reviews

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DNA Modeling within Ab Initio and Empirical Methods
pp. 349-383(35)
Authors: Cozmuta, I.; Mehrez, H.

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Logic Design of Computational Nanostructures
pp. 384-407(24)
Author: Yanushkevich, Svetlana N.

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Electron Transport in Quantum Waveguides
pp. 408-432(25)
Authors: Wang, J. B.; Midgley, S.

Research Articles

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Horizontal Ge-Substituted Polymantane-Based C2 Dimer Placement TooltipMotifs for Diamond Mechanosynthesis
pp. 433-442(10)
Authors: Freitas, Robert A.; Allis, Damian G.; Merkle, Ralph C.

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Ultraviolet Optical Absorption Spectra of Water Clusters: From Molecular Dimer to Nanoscaled Cage-Like Hexakaidecahedron
pp. 453-466(14)
Authors: Xie, John R. H.; Zhao, Jijun; Kar, Tapas; Ludwig, Ralf

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Spatial Systolic Arrays Design for Predictable Nanotechnologies
pp. 467-481(15)
Author: Yanushkevich, S. N.

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A Molecular Dynamics Study of Laser-Assisted Cleaning: Energy Transfer Medium-Contaminant Particle Interaction
pp. 488-493(6)
Authors: Unlusu, Betul; Smith, Kayne M.; Hussaini, M. Yousuff; Gelb, Lev D.; Allen, Susan D.

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An Integrated Simulation Environment Realizing the Ability of Nano-Photonic Crystals to Detect and Quantify Submicron and Microdamage in Materials
pp. 494-503(10)
Authors: Taha, M. M. Reda; El-Kady, I.; Sheyka, M. P.; Su, M. F.; Khraishi, T. A.; El-Osery, A. I.; Verley, J. C.

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Buckled Nano Rod—A Two State System and Its Dynamics
pp. 504-513(10)
Authors: Chakraborty, Aniruddha; Bagchi, Sayan; Sebastian, K. L.

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Balaban Index of an Armchair Polyhex, TUC4C8(R) and TUC4C8(S) Nanotorus
pp. 514-517(4)
Authors: Iranmanesh, Ali; Ashrafi, Ali Reza

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DNA Conduction
pp. 518-520(3)
Authors: Mu, Weihua; Ou-Yang, Zhong-Can

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Formation and Stability Conditions of DNA-Dendrimer Nano-Clusters
pp. 521-528(8)
Authors: Nikakhtar, Ali; Nasehzadeh, Asadollah; Mansoori, G. Ali

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Study of Solid–Liquid Phase Changes of Lennard-Jones Nanoclusters by NPT Monte Carlo Simulations
pp. 529-534(6)
Authors: Gatica, Silvina M.; Dong, Xiao; Blaisten-Barojas, Estela

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Carbon Nanotube Thin Film Field Emitting Diode: Understanding the System Response Based on Multiphysics Modeling
pp. 535-549(15)
Authors: Sinha, N.; Mahapatra, D. Roy; Yeow, J. T. W.; Melnik, R. V. N.; Jaffray, D. A.

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Einstein Relation in Quantum Wells and Nipi Structures of Nonlinear Optical, Optoelectronic and Related Materials: Simplified Theory, Relative Comparison and Suggestion for an Experimental Determination
pp. 550-573(24)
Authors: Mukherjee, S.; Mitra, S. N.; Bose, P. K.; Ghatak, A. R.; Neogi, A.; Banerjee, J. P.; Sinha, A.; Pal, M.; Bhattacharya, S.; Ghatak, K. P.

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Carbon Nanotube Electronic Displacement Encoder with Sub-Nanometer Resolution
pp. 574-577(4)
Authors: Jiang, H.; Yu, M.-F.; Lu, J.-Q.; Huang, Y.; Johnson, H. T.; Zhang, X.-G.; Ferreira, P.

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The Effect of Defects on the Mechanical Behavior of Silver Shape Memory Nanowires
pp. 578-587(10)
Authors: Ji, Changjiang; Park, Harold S.

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Cluster Origin of the Transfer Phenomena of Single-Wall Carbon Nanotubes
pp. 588-603(16)
Authors: Torrens, Francisco; Castellano, Gloria

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PI Index of V-Phenylenic Nanotubes and Nanotori
pp. 604-605(2)
Authors: Yousefi, H.; Bahrami, A.; Yazdani, J.; Ashrafi, A .R.

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Carbon Nanotubes as Gun and Molecular Motor
pp. 606-610(5)
Authors: Nero, Jordan Del; Neto, A. M. J. C.

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Carbon Nanotube and Ordinary Nanowire Track as Molecular Motor
pp. 611-613(3)
Author: Neto, A. M. J. C.

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A Practical V-Shaped Nano-Aperture Flanked with Surface Corrugationsfor Beam Focusing
pp. 614-618(5)
Authors: Fu, Yongqi; Zhou, Wei; Lim, Lennie E. N.; Du, Chunlei; Shi, Haofei; Wang, Changtao; Luo, Xiangang

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Statistical and Dynamical Equivalence of Different Elementary Cells
pp. 619-626(8)
Authors: Sajfert, Vjekoslav; J├ícimovski, Stevo; Popov, Dušan; Tošić, Bratislav

Preface

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Research Articles

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Higher-Order Time-Domain Simulations of Maxwell's Equations Using Krylov-Subspace Methods
pp. 627-634(8)
Authors: Niegemann, Jens; Tkeshelashvili, Lasha; Busch, Kurt

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Finite-Difference Time-Domain Modeling of Decay Rates in the Near Field of Metal Nanostructures
pp. 635-643(9)
Authors: Kaminski, F.; Sandoghdar, V.; Agio, M.

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Efficient Effective Permittivity Treatment for the 2D-FDTD Simulation of Photonic Crystals
pp. 644-648(5)
Authors: Jalali, T.; Rauscher, K.; Mohammadi, A.; Erni, D.; Hafner, Ch.; Baechtold, W.; Shoushtari, M. Z.

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Diffraction Analysis of Periodic Structures Using a Transmission-Line Formulation: Principles and Applications
pp. 649-666(18)
Authors: Fallahi, Arya; Aghaie, Kiarash Zamani; Enayati, Amin; Shahabadi, Mahmoud

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Method of Auxiliary Sources and Model-Based Parameter Estimation for the Computation of Periodic Structures
pp. 667-674(8)
Authors: Tavzarashvili, K.; Hafner, Ch.; Xudong, Cui; Vahldieck, Ruediger; Kakulia, D.; Ghvedashvili, G.; Karkashadze, D.

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Numerical Optimization of Photonic Crystal Structures
pp. 675-685(11)
Authors: Smajic, Jasmin; Hafner, Christian; Xudong, Cui; Vahldieck, Ruediger

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Field Computations of Optical Antennas
pp. 686-691(6)
Authors: Kappeler, Roman; Erni, Daniel; Xudong, Cui; Novotny, Lukas

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Polarization Mode Coupling due to Metal-Layer Modifications in Apertureless Near-Field Scanning Optical Microscopy Probes
pp. 692-703(12)
Authors: Nakagawa, Wataru; Vaccaro, Luciana; Herzig, Hans Peter; Hafner, Christian

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