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Understanding the Contributions of Microscopic Heat Transfer to Thermal Conductivities of Liquid Aldehydes and Ketones by Molecular Dynamics Simulation.
Fan Yang
Haixia Lu
Wanqiang Liu
Hu Zhou
Published in:
J. Chem. Inf. Model. (2020)
Keyphrases
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heat transfer
molecular dynamics
fluid flow
molecular dynamics simulations
numerical simulations
temperature field
computational fluid dynamics
mathematical models
scientific data
finite element method
flow rate
thermal conductivity
high performance computing
water flow
protein folding
fine grained
computer vision