scholarly journals Communication: Quantum molecular dynamics simulation of liquid para-hydrogen by nuclear and electron wave packet approach

2014 ◽  
Vol 140 (17) ◽  
pp. 171101 ◽  
Author(s):  
Kim Hyeon-Deuk ◽  
Koji Ando
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Wave Packet ◽  
Dynamics Simulation ◽  
Quantum Molecular Dynamics ◽  
Para Hydrogen ◽  
Electron Wave ◽  
Electron Wave Packet

A quantum molecular dynamics simulation of an excess electron in methanol

1993 ◽  
Vol 98 (7) ◽  
pp. 5679-5693 ◽  
Author(s):  
Jianjun Zhu ◽  
R. I. Cukier
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Excess Electron ◽  
Dynamics Simulation ◽  
Quantum Molecular Dynamics

scholarly journals Advanced analysis of laser-driven pulsed magnetic diffusion based on quantum molecular dynamics simulation

2021 ◽  
Vol 6 (6) ◽  
pp. 065901
Author(s):  
Hiroki Morita ◽  
Tadashi Ogitsu ◽  
Frank R. Graziani ◽  
Shinsuke Fujioka
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Dynamics Simulation ◽  
Quantum Molecular Dynamics ◽  
Magnetic Diffusion ◽  
Advanced Analysis

Path integral molecular dynamics simulation of solid para-hydrogen with an aluminum impurity

2002 ◽  
Vol 365 (5-6) ◽  
pp. 487-493 ◽  
Author(s):  
Dina T Mirijanian ◽  
Millard H Alexander ◽  
Gregory A Voth
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Path Integral ◽  
Dynamics Simulation ◽  
Para Hydrogen

A Quantum Molecular Dynamics Simulation Study of the Initial Hydrolysis Step in Sol−Gel Process

2003 ◽  
Vol 107 (7) ◽  
pp. 1518-1524 ◽  
Author(s):  
Mohamed Elanany ◽  
Parasuraman Selvam ◽  
Toshiyuki Yokosuka ◽  
Seiichi Takami ◽  
Momoji Kubo ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Simulation Study ◽  
Sol Gel ◽  
Dynamics Simulation ◽  
Quantum Molecular Dynamics ◽  
Sol Gel Process
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