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most citedMoiré-Driven Interfacial Thermal Transport in Twisted Transition Metal Dichalcogenides

31 citations · 173 across the 10 of their papers we have counts for

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6 papers · 1 filter

cond-mat.mtrl-sci2025

Device-Scale Atomistic Simulations of Heat Transport in Advanced Field-Effect Transistors

Ke Xu, Gang Wang, Ting Liang +8

Self-heating in next-generation, high-power-density field-effect transistor limits performance and complicates fabrication. Here, we introduce NEP-FET, a machine-learned framework…

physics.comp-ph2025★ 4 cited

Accurate Modeling of Interfacial Thermal Transport in van der Waals Heterostructures via Hybrid Machine Learning and Registry-Dependent Potentials

Wenwu Jiang, Hekai Bu, Ting Liang +4

Two-dimensional transition metal dichalcogenides (TMDs) exhibit remarkable thermal anisotropy due to their strong intralayer covalent bonding and weak interlayer van der Waals (vdW…

physics.comp-ph2025★ 28 cited

PYSED: A tool for extracting kinetic-energy-weighted phonon dispersion and lifetime from molecular dynamics simulations

Ting Liang, Wenwu Jiang, Ke Xu +4

Machine learning potential-driven molecular dynamics (MD) simulations have significantly enhanced the predictive accuracy of thermal transport properties across diverse materials.…

cond-mat.mtrl-sci2025★ 31 cited

Moiré-Driven Interfacial Thermal Transport in Twisted Transition Metal Dichalcogenides

Wenwu Jiang, Ting Liang, Hekai Bu +2

Cross-plane thermal conductivity in homogeneous transition metal dichalcogenides (TMDs) exhibits a strong dependence on twist angle, originating from atomic reconstruction within m…

cond-mat.mtrl-sci2025★ 22 cited

NEP89: Universal neuroevolution potential for inorganic and organic materials across 89 elements

Ting Liang, Ke Xu, Eric Lindgren +16

While machine-learned interatomic potentials offer near-quantum-mechanical accuracy for atomistic simulations, many are material-specific or computationally intensive, limiting the…

physics.comp-ph2025★ 17 cited

Probing the ideal limit of interfacial thermal conductance in two-dimensional van der Waals heterostructures

Ting Liang, Ke Xu, Penghua Ying +9

Probing the ideal limit of interfacial thermal conductance (ITC) in two-dimensional (2D) heterointerfaces is of paramount importance for assessing heat dissipation in 2D-based nano…