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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 3, Number 1, February 2006

Reviews

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First-Principles Calculations Applied to Molecular Magnetism
pp. 11-27(17)
Authors: Kortus, Jens; Massobrio, Carlo; Drillon, Marc

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Research Articles

Theoretical Analysis of Diamond Mechanosynthesis. Part III. Positional C2 Deposition on Diamond C(110) Surface Using Si/Ge/Sn-Based Dimer Placement Tools
pp. 28-41(14)
Authors: Peng, Jingping; Freitas, Robert A.; Merkle, Ralph C.; Von Ehr, James R.; Randall, John N.; Skidmore, George D.

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Device Engineering Approaches to the Simulation of Charge Transport in Biological Ion Channels
pp. 42-62(21)
Authors: van der Straaten, T. A.; Kathawala, G.; Ravaioli, U.

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Structural and Dynamical Classification of RNA Single-Base Bulges for Nanostructure Design
pp. 63-77(15)
Authors: Hastings, Whitney A.; Yingling, Yaroslava G.; Chirikjian, Gregory S.; Shapiro, Bruce A.

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Selectivity of the Chelator-Protein Interactions: A High Level Quantum Chemistry Study
pp. 78-87(10)
Authors: Stepanian, Stepan G.; Trzaskowski, Bartosz; Deymier, Pierre A.; Guzman, Roberto; Adamowicz, Ludwik

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Quantum Nanojet Structures: Quantum Branching and Clustering in Two-Slit Electron Jets
pp. 88-100(13)
Authors: Chiu, H. H.; Lin, C. T.; Lin, S. Y.; Madarasz, F. L.

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Study of Isomeric Structures of Cun(n = 1–5) Nanowires: An Ab-Initio Approach
pp. 110-117(8)
Authors: Srivastava, Pankaj; Agrawal, B. K.

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Adaptive Tempering Monte Carlo Method
pp. 118-127(10)
Authors: Dong, Xiao; Blaisten-Barojas, Estela

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A Hybrid Density Functional Study of Armchair Si and Ge Nanotubes
pp. 128-133(6)
Authors: Pradhan, Prachi; Ray, Asok K.

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An Analytic Model for Nano Confined Fluids Phase-Transition: Applications for Confined Fluids in Nanotube and Nanoslit
pp. 134-141(8)
Authors: Keshavarzi, Tahmineh; Sohrabi, Rezvan; Mansoori, G. Ali

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Studies of Carbon Nanotube-Based Oscillators Using Molecular Dynamics
pp. 142-147(6)
Authors: Xiao, Shaoping; Andersen, David R.; Han, Ray P.; Hou, Wenyi

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Strains in Axial and Lateral Directions in Carbon Nanotubes
pp. 148-152(5)
Authors: Jindal, Prashant; Jindal, V. K.

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