A Basic Study of the CNT-Biomolecule Conjugation by Molecular Dynamics Analysis

Authors: S.M. Kim, Hyun Kyu Kweon

A Candidate for Grain Boundary Pipe Diffusion and Intrinsic Electrical Activity in Silicon

Authors: O.B.M. Hardouin Duparc, M. Torrent

A Computational Model for Nano Scale Cavities in the Atomic Structure of Polymer Melt and Comparisons to PALS

Authors: Dušan Račko

A Cross-Scale Characterization of Interface Properties between Carbon Nanotubes and Polymer Matrix

Authors: Kausala Mylvaganam, Liang Chi Zhang

A Molecular Dynamics Simulation of Oxygen Diffusion in MgO Stabilized Zirconia

Authors: Sen Wang, Zhi Hui Li, Xin Liu, Huan Zhang

A Molecular Dynamics Study for Dissociation of H₂ Molecule on Pt(111) Surface

Authors: Takashi Tokumasu

A Molecular Dynamics Study of Large Deformation of Nanocrystalline Materials

Authors: H. Ogawa, N. Sawaguchi, Fumihiro Wakai

A Molecular Dynamics Study on Pressure Dependence of Ag Diffusion in Ag₃SI

Authors: Masakazu Yarimitsu, Masaru Aniya

A Multiscale Deformation Analysis for Mono-Crystalline Copper under Dynamic Uniaxial Tension

Authors: Yuan Tong Gu, Prasad K.D.V. Yarlagadda

A Multi-Scale Modeling Approach to Simulate Intergranular Crack Propagation in Textured Polycrystalline Materials

Authors: Muhammad A. Arafin, Jian Lu, Jerzy Szpunar