Atomic Simulation on Deformation of Single-Wall Carbon Nanotube Based on Tight-Binding Molecular Dynamics
Yoshitaka UMENO, Takayuki KITAMURA and Eiji MATSUI
The Development of Molecular Dynamics Potential for Si-H System and Its Application to the CVD Reaction Process
Satoshi IZUMI, Yuusuke SATO, Shotaro HARA and Shinsuke SAKAI
The Interface Energy and Interface Stress of Amorphous Silicon
Satoshi IZUMI, Shotaro HARA and Shinsuke SAKAI
Molecular Dynamics Simulation of Deformation-Induced Nanocrystallization in an Amorphous Metal
Ryosuke MATSUMOTO, Hiroshi KITAGAWA and Akihiro NAKATANI
Lattice Instability Analysis of Silicon and Aluminum under [001] Uniaxial Tension by Means of ab initio Molecular Dynamics
Kisaragi YASHIRO, Masashi OHO, Katsuya YAMAGAMI and Yoshihiro TOMITA
Visualization of Internal Deformation and Fracture of Three-Dimensional Crystal Structure
Tadashi OGIHARA, Ryoukichi HAMAJIMA and Mitsuaki MOTOJIMA
Molecular Dynamics Simulation of Mechanical Behaviors of a System Including Both a Crack and Grain Boundaries under Cyclic Loading
Kenji NISHIMURA and Noriyuki MIYAZAKI
Development of More Efficient Programs for the First-Principles Molecular-Dynamics Method Using the RMM-DIIS Scheme
Masanori KOHYAMA, Shingo TANAKA and Kazuyuki OKAZAKI
