scholarly journals Machine learning prediction of self-diffusion in Lennard-Jones fluids

2020 ◽  
Vol 153 (3) ◽  
pp. 034102 ◽  
Author(s):  
Joshua P. Allers ◽  
Jacob A. Harvey ◽  
Fernando H. Garzon ◽  
Todd M. Alam
Keyword(s):  
Machine Learning ◽  
Self Diffusion ◽  
Lennard Jones

Machine Learning Self-Diffusion Prediction for Lennard-Jones Fluids in Pores

2021 ◽  
Author(s):  
Calen J. Leverant ◽  
Jacob A. Harvey ◽  
Todd M. Alam ◽  
Jeffery A. Greathouse
Keyword(s):  
Machine Learning ◽  
Self Diffusion ◽  
Lennard Jones ◽  
Diffusion Prediction

Effect of the computational domain size and shape on the self-diffusion coefficient in a Lennard-Jones liquid

2015 ◽  
Vol 142 (2) ◽  
pp. 024503 ◽  
Author(s):  
Gota Kikugawa ◽  
Shotaro Ando ◽  
Jo Suzuki ◽  
Yoichi Naruke ◽  
Takeo Nakano ◽  
...  
Keyword(s):  
Diffusion Coefficient ◽  
Domain Size ◽  
The Self ◽  
Computational Domain ◽  
Size And Shape ◽  
Self Diffusion ◽  
Lennard Jones ◽  
Self Diffusion Coefficient
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