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Neutral gold clusters studied by the isothermal Brownian-type molecular dynamics and metadynamics molecular dynamics simulations
San Kiong Lai, Chong Chiat Lim
物理學系
研究成果
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雜誌貢獻
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期刊論文
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2
引文 斯高帕斯(Scopus)
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Keyphrases
Molecular Dynamics Simulation
100%
Molecular Dynamics
100%
Gold Clusters
100%
Metadynamics
100%
Parametrization
80%
Non-planar
60%
Variable Space
40%
Collective Variables
40%
E-band
40%
Gas Phase
20%
Banded Structure
20%
Simulation Study
20%
Spectroscopic Measurement
20%
Simulation Data
20%
Valence Electrons
20%
Energy Function
20%
Energy Barrier
20%
Au Clusters
20%
Free Energy Landscape
20%
Dynamic Strategy
20%
Fluxional
20%
Fluxionality
20%
Planar Clusters
20%
Molecular Dynamic Algorithm
20%
Mathematics
Simulation Study
100%
Energy Function
100%
Experimental Data
100%
Relative Importance
100%
Dynamic Algorithms
100%
Vapor Phase
100%
Biochemistry, Genetics and Molecular Biology
Dynamics
100%
Metadynamic
100%
Energy Landscape
20%
Material Science
Electronic Band Structure
100%
Energy Landscape
100%
Chemistry
Molecular Dynamics
100%
Electronic Band Structure
11%
Energy Barrier
11%
Spectroscopy
11%
Free Energy
11%
Molecular dynamics simulation
11%
Energy Landscape
11%
Physics
Molecular Dynamics
100%
Vapor Phase
10%
Free Energy
10%