Journal of Computational and Theoretical Nanoscience

 

Volume 1, Number 1 (March 2004)

 

EDITORIAL
Welcome to the Journal of Computational and Theoretical Nanoscience
Michael Rieth and Wolfram Schommers

REVIEW
Tight-Binding Molecular Dynamics for Carbon and Applications to Nanostructure Formation
C. Z. Wang and K. M. Ho

RESEARCH PAPERS
Computational Studies of Viral Protein Nano-Actuators
A. Dubey,G. Sharma, C. Mavroidis, S. M. Tomassone, K. Nikitczuk, and M. L. Yarmush

Multi-scale Modeling of Si and C Nanocluster Nucleation During Non-equilibrium Gas Phase Processing
Gregory A. Johnson and Nasr M. Ghoniem

Metallic Nanoclusters – Computational Investigations of Their Applications as Building Blocks in Nanotechnology
Michael Rieth and Wolfram Schommers

Computational Neurogenetics
Nikola Kasabov and Lubica Benuskova

Theoretical Analysis Of Diamond Mechanosynthesis. Part I. Stability Of C2 Mediated Growth of Nanocrystalline Diamond C(110) Surface
Jingping Peng, Robert A. Freitas Jr., and Ralph C. Merkle

Theoretical Analysis of Diamond Mechanosynthesis. Part II. C2 Mediated Growth of Diamond C(110) Surface via Si/Ge-Triadamantane Dimer Placement Tools
David J. Mann, Jingping Peng, Robert A. Freitas Jr., and Ralph C. Merkle

A Nanoscale Spring-Loaded Valve Actuated to Colloidal Forces
Jonathan Fuchser, Prodip K. Das, Walied Moussa, and Subir Bhattacharjee

Adsorption and Vibrational Properties of H2O Monomer on NaCl(100) Surface
Yong Yang and E. G. Wang


Structural Transition of Copper Nanowires Confined in Single-walled Carbon Nanotubes
Yufeng Guo; Yong Kong, Wanlin Guo, and Huajian Gao


Computational Analysis of Transition Metal Doped Nanotubes and Their Application to Molecular Electronics
Dan A. Buzatu, Freddy T. Nguyen, Shreedhar N. Reddy, and Jerry A. Darsey


Infrared, Raman, NMR Spectra, and Low-Energy Optical Excitations of Heterofullerene C48B12
Rui-Hua Xie, Qin Rao and Vedene H. Smith Jr.

 

 

 






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