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20222025
most citedSimulations of Heat Transport in Single-Molecule Junctions: Investigations of the Thermal Diode Effect

15 citations · 17 across the 5 of their papers we have counts for

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cond-mat.mes-hall2023

Challenges in molecular dynamics simulations of heat exchange statistics

Jonathan J. Wang, Matthew Gerry, Dvira Segal

We study heat exchange in temperature-biased metal-molecule-metal molecular junctions by employing the LAMMPS atomic molecular dynamics simulator. Generating the nonequilibrium ste…