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Home / Journal of Computational and Theoretical Nanoscience, Volume 8, Number 10
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 8, Number 10, October 2011

Research Articles

Pressure-Induced Structural Analysis of ZrO2 Nanoparticle: Molecular Dynamics Simulation
pp. 1901-1909(9)
Authors: Liang, Peng; Zhang, Yonghong; Huang, Shiping; Wang, Peng; Tian, Huiping

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Dissipative Particle Dynamics Simulation of Self-Assembly of Phosphorylcholine-Containing Poly(L-lactide)
pp. 1910-1915(6)
Authors: Wang, Zhigao; Chen, Yuanwei; Li, Jiehua; Luo, Xianglin; Tan, Hong

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Polarization Modes Control on the Transmittance Characteristics of One Dimensional Photonic Crystal
pp. 1916-1919(4)
Authors: Aly, Arafa H.; Hanafey, Hassan S.

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Comparison Study on the Electronic Structure of Smallest (2, 2) Carbon Nanotube by Ultra-Soft Pseudo-Potential and All-Electron Methods
pp. 1920-1924(5)
Authors: Mao, Yuliang; Yuan, Jianmei; Zhong, Jianxin

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Protein–Protein Interaction Extraction Based on Improved All-Paths Kernel
pp. 1925-1932(8)
Authors: Zhang, Yijia; Lin, Hongfei; Yang, Zhihao; Li, Yanpeng

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A Revisit to Capture the Entire Behavior of Ultrasonic Wave Dispersion Characteristics of Single Walled Carbon Nanotubes Based on Nonlocal Elasticity Theory and Flügge Shell Model
pp. 1933-1944(12)
Authors: Narendar, S.; Gopalakrishnan, S.

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Quantitative Structure-Activity Relationship (QSAR) on New Benzothiazoles Derived Substituted Piperazine Derivatives
pp. 1945-1949(5)
Authors: Al-Masoudi, Najim A.; Salih, Basil; Al-Soud, Yaseen A.

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Theoretical and Computational Modeling of Endohedral Functionalization Energy for Armchair Models of Nanotubes
pp. 1950-1953(4)
Author: Fusaro, Massimo

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Variational Principles for Vibrating Carbon Nanotubes Modeled as Cylindrical Shells Based on Strain Gradient Nonlocal Theory
pp. 1954-1962(9)
Author: Adali, Sarp

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Effects of Magnetic Fields on the Synchronization of Calcium Oscillations in Coupled Cells
pp. 1963-1966(4)
Authors: Zhang, Yuhong; Zhao, Yongli; Han, Yingrong; Liu, Hui; Zhan, Yong

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Design and Modeling of Carbon Nanotube Electromechanical Switches for Logic Device Application
pp. 1967-1972(6)
Authors: Peng, Bei; Ding, Li; Guo, Zaoyang

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Theoretical and Experiment Investigation on I–V Characteristics of Carbon Nanotube Based Device
pp. 1973-1976(4)
Authors: Wu, Ying; Bai, Junjie; Chen, Aixi; Zhou, Zhaoying; Xiang, Yi

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Quantum Transport Through Mesoscopic Rings: A Way of Current Modulation
pp. 1977-1981(5)
Author: Maiti, Santanu K.

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Toward Mechanosynthesis of Diamondoid Structures: VIII. Quantum-Chemical Molecular Dynamics Simulations of Hexagonal Silicon-IV Structure Synthesis with STM
pp. 1982-1985(4)
Author: Herman, Aleksander

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Analysis of the Nano-Surface of a Modified Glassy Carbon Electrode by Pseudo Phase Plane Method
pp. 1986-1992(7)
Authors: Machado, J. A. Tenreiro; Baleanu, Dumitru; Dinç, Erdal; Solak, Ali Osman; Eķsi, Haslet; Güzel, Remziye

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Ballistic Conductance Model of Bilayer Graphene Nanoribbon (BGN)
pp. 1993-1998(6)
Authors: Sadeghi, Hatef; Ahmadi, M. T.; Ishak, B. I.; Mousavi, S. M.; Ismail, Razali

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A Cellular Automaton Approach to the Simulation of Active Self-Assembly of Kinesin-Powered Molecular Shuttles
pp. 1999-2005(7)
Authors: Crenshaw, Jasmine D.; Liang, Tao; Hess, Henry; Phillpot, Simon R.

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Airy Stress Functions for Transverse Sinusoidally Loaded Beam in Nonlocal Elasticity
pp. 2006-2012(7)
Author: Yayli, Mustafa Özgür

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Simulation of Program/Erase and Capacitance-Voltage Characteristics of Metal Nanocrystal Memory
pp. 2013-2018(6)
Authors: Cheng, Pei-Hong; Huang, Shi-Hua; Wu, Feng-Min

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Wave Propagation and Scattering in Deformed Single-Wall Carbon Nanotubes
pp. 2019-2024(6)
Authors: Lin, Chuan; Wang, Hongtao; Yang, Wei

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Analytic Solution for Symmetric DG MOSFETs with Gate-Oxide-Thickness Asymmetry
pp. 2025-2028(4)
Authors: Baruah, R. K.; Bora, N.

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Bilayer Graphene Nanoribbon Carrier Statistic in Degenerate and Non Degenerate Limit
pp. 2029-2032(4)
Authors: Mousavi, S. Mahdi; Ahmadi, Mohammad Taghi; Sadeghi, Hatef; Nilghaz, Azadeh; Amin, Azizah; Johari, Zaharah; Ismail, Razali

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Numerical and Analytical Solution of Gas Flow Through a Micro-Nano Porous Media: A Comparison
pp. 2033-2041(9)
Authors: Rad, J. A.; Ghaderi, S. M.; Parand, K.

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Application of 3D DNA Self-Assembly for Graph Coloring Problem
pp. 2042-2049(8)
Authors: Zhang, Xuncai; Lin, Minqi; Niu, Ying

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Influence of Defects During the Tensile Deformation of Cu–Al Joint Interfaces at the Nano Scale
pp. 2050-2057(8)
Authors: Wang, L.; Zhang, H. W.; Deng, X.

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A Conformational Study of (E)- and (Z)-Pyridine-2-Carbaldehyde-2′-Pyridylhydrazone
pp. 2058-2060(3)
Authors: Dias, Daniel S. S.; Barros, Tainá G.; Andrade, Marcieni A.; Baetas, Ana C.; Fontes, Enéas A.; Silva, Marcos V. S.; Barros, Carlos A. L.; Borges, Rosivaldo S.

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An Electronic Study of Tocopherol-Ring Regioisomers as Antioxidants
pp. 2061-2065(5)
Authors: Braga, Rogério P.; Moraes, Fransuelen K. C.; Manhaes, Melissa M.; Andrade, Marcieni A.; Baetas, Ana C.; Almeida, Eduardo D.; Fontes, Enéas A.; Silva, Marcos V. S.; Silva, Milton N.; Arruda, Mara S. P.; Borges, Rosivaldo S.

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Reading What Machines "Think": A Challenge for Nanotechnology
pp. 2066-2071(6)
Authors: Prezioso, Stefano; Croce, Danilo; Zanzotto, Fabio Massimo

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Modelling Carbon Nanostructures for Filtering and Adsorbing Polycyclic Aromatic Hydrocarbons
pp. 2072-2077(6)
Authors: Tran-Duc, Thien; Thamwattana, Ngamta

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Prefoldin: A Nano Actuator for Carrying the Various Size Nano Drugs
pp. 2078-2086(9)
Authors: Ghaffari, A.; Shokuhfar, A.; Ghasemi, R. Hasanzadeh

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Evaluating the Effect of Mechanical Loading on the Electrical Percolation Threshold of Carbon Nanotube Reinforced Polymers: A 3D Monte-Carlo Study
pp. 2087-2099(13)
Authors: Ghazavizadeh, A.; Baniassadi, M.; Safdari, M.; Atai, A. A.; Ahzi, S.; Patlazhan, S. A.; Gracio, J.; Ruch, D.

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Characteristics of Three-Dimensional Simulation and Design of Fin Field Effect Transistors with 37∼18 nm Channel Length
pp. 2100-2107(8)
Author: Liou, Bor-Wen

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An Effective Gene Selection Method for Cancer Classification Based on Locally Linear Embedding
pp. 2108-2111(4)
Authors: Lang, Yongxiang; Qin, Zheng; Li, Xing

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DNA Directed Model for Shortest Superstring Problem
pp. 2112-2117(6)
Authors: Xikui, Liu; Yan, Li; Jin, Xu

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Nonlocal Plate Model for the Free Vibration Analysis of Nanoplates with Different Boundary Conditions
pp. 2118-2128(11)
Authors: Shakouri, A.; Ng, T. Y.; Lin, R. M.

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Thermal Conductivity Calculation with the Molecular Dynamics Direct Method I: More Robust Simulations of Solid Materials
pp. 2129-2143(15)
Author: Howell, P. C.

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Thermal Conductivity Calculation with the Molecular Dynamics Direct Method II: Improving the Computational Efficiency
pp. 2144-2154(11)
Author: Howell, P. C.

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Prediction of Protein Function Using Ant Colony Sequence Alignment
pp. 2155-2158(4)
Authors: Zeng, Qingguang; Liao, Bo; Liu, Hao; Li, Dachao; Li, Renfa

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Structural and Electronic Properties of Ammonia Adsorption on the C30B15N15 Heterofullerene: A Density Functional Theory Study
pp. 2159-2165(7)
Authors: Zahedi, Ehsan; Seif, Ahmad; Ahmadi, Temer S.

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Single Electron's Dynamical Behavior in a Two Dimensional Anisotropic Quantum Dot with Account of Rashba Effect
pp. 2166-2171(6)
Authors: Sisakhti, Masoumeh; Golshan, Mohammad Mehdi; Sanaee, Maryam

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