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Achievements and prospects of molecular dynamics simulations in thermofluid sciences
Y Ran, V Bertola - Energies, 2024 - mdpi.com
In the last decades, molecular dynamics (MD) simulations established as an important tool
for solving fluid flow and heat transfer problems at the nanoscale, with a significant …
for solving fluid flow and heat transfer problems at the nanoscale, with a significant …
Surface wettability effects on evaporating meniscus in nanochannels
Systematic investigations of self-regulation of evaporating menisci in nanochannels are
conducted as a function of the surface wettability under various applied heat flux conditions …
conducted as a function of the surface wettability under various applied heat flux conditions …
A first look at the performance of nano-grooved heat pipes
Passive thermal spreaders utilizing liquid/vapor phase-change mechanism such as heat
pipes, have been widely used in the macro-scale thermal management of electronic devices …
pipes, have been widely used in the macro-scale thermal management of electronic devices …
Mesoscale simulations on the ultrahigh heat flux evaporation of R143a within ultrathin nanoporous membrane using a modified dimensionless lattice Boltzmann …
A modified dimensionless pseudo-potential lattice Boltzmann method capable of restoring
all related thermophysical properties of any working fluid and spatial/temporal scales of the …
all related thermophysical properties of any working fluid and spatial/temporal scales of the …
Nanoscale meniscus dynamics in evaporating thin films: insights from molecular dynamics simulations
Evaporation studies are focused on unraveling heat transfer and flow dynamics near the
solid–liquid–vapor contact line, particularly focusing on the meniscus, which encompasses …
solid–liquid–vapor contact line, particularly focusing on the meniscus, which encompasses …
Atomic scale interfacial transport at an extended evaporating meniscus
Recent developments in fabrication techniques have enabled the production of nano-and
Ångström-scale conduits. While scientists are able to conduct experimental studies to …
Ångström-scale conduits. While scientists are able to conduct experimental studies to …
Drifting mass accommodation coefficients: in situ measurements from a steady state molecular dynamics setup
ABSTRACT A fundamental understanding of the evaporation/condensation phenomena is
vital to many fields of science and engineering, yet there is many discrepancies in the usage …
vital to many fields of science and engineering, yet there is many discrepancies in the usage …
Evaporation from nanoscale thin films and menisci: Experiments, theories, and simulations
2 2 3 6 3. Continuum modeling 9 3.1 Equilibrium conditions 9 3.2 Evaporating menisci 13
3.3 Non-equilibrium effects 14 4. Molecular dynamics 16 4.1 Introduction to molecular …
3.3 Non-equilibrium effects 14 4. Molecular dynamics 16 4.1 Introduction to molecular …
Energy-based interface detection for phase change processes of monatomic fluids in nanoconfinements
An energy-based liquid–vapor interface detection method is presented using molecular
dynamics simulations of liquid menisci confined between two parallel plates under …
dynamics simulations of liquid menisci confined between two parallel plates under …
[PDF][PDF] Machine learned coarse grain water models for evaporation studies
S Yesudasan, R Averett, S Chacko - Preprints, 2020 - preprints.org
Evaporation studies of water using classical molecular dynamics simulations are largely
limited due to its high computational expense. We aim at addressing the computational …
limited due to its high computational expense. We aim at addressing the computational …