搜索结果: 1-7 共查到“理论物理学 Molecular Dynamics”相关记录7条 . 查询时间(0.031 秒)
Molecular-dynamics Simulations of Stacking-fault-induced Dislocation Annihilation in Pre-strained Ultrathin Single-crystalline Copper Films
Molecular dynamics dynamic deformation metal structure
2014/12/19
We report results of large-scale molecular-dynamics (MD) simulations of dynamic deformation under biaxial tensile strain of pre-strained single-crystalline nanometerscale- thick face-centered cubic (f...
A Quantum Algorithm for Molecular Dynamics Simulation
Quantum Algorithm Molecular Dynamics Simulation
2010/4/9
Quantum computers could potentially simulate the dynamics of systems such as polyatomic molecules on a much larger scale than classical computers. We investigate a general quantum computational algori...
Molecular Dynamics Study of Gases H2, D2 and
T2
molecular dynamics simulation
equation of state hydrogen and its isotope gases interaction
potential isotope mass effect
2007/8/15
2002Vol.37No.2pp.225-230DOI:
Molecular Dynamics Study of Gases H2, D2 and
T2
YANG Chuan-Lu,1 ZHU Zheng-He,2 WANG Rong,2 ZHANG Zhi-Hong,1 REN Ting-Qi,1 WANG Ming-Da,3 ZHANG Yong-M...
Molecular Dynamics Study of Effects of Si-Doping Upon
Structure and Mechanical Properties of Carbon Nanotube
molecular dynamics simulation carbon nanotubes Young's modulus Si-doping
2007/8/15
2006Vol.45No.4pp.741-744DOI:
Molecular Dynamics Study of Effects of Si-Doping Upon
Structure and Mechanical Properties of Carbon Nanotube
SONG Hai-Yang, SUN He-Ming, and ZHANG Guo...
Elastic Constants of Superconducting MgB2 from
Molecular Dynamics Simulations with Shell Model
MgB2 elastic constants shell model molecular dynamics
2007/8/15
2005Vol.44No.5pp.936-940DOI:
Elastic Constants of Superconducting MgB2 from
Molecular Dynamics Simulations with Shell Model
GUO Yun-Dong,1,2 CHEN Xiang-Rong,1,3 YANG Xiang-Dong,1 ...
Stochastic Molecular Dynamics of Colloidal Particles
Stochastic Molecular Dynamics Colloidal Particles
2010/10/19
Colloidal particles move in the carrier liquid under the action of several forces and torques. When the particles carry a dipole moment, electric or magnetic, as in ferrofluids, the rotational and tra...
Molecular Dynamics Simulations of Super Heated Ni4 Cluster
microcanonical molecular dynamics cluster fragmentation
2010/4/15
The fragmentation mechanism of the super heated Ni4 cluster is studied by employing the microcanonical molecular dynamics simulations and an empirical model potential. Ni4 cluster is heated up above t...