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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 ...