We present our latest advancements of machine-learned potentials (MLPs) based on the
neuroevolution potential (NEP) framework introduced in Fan et al.[Phys. Rev. B 104, 104309 …

Diamond possesses excellent thermal conductivity and tunable bandgap. Currently, the high‐
pressure, high‐temperature, and chemical vapor deposition methods are the most promising …

Abstract Two-dimensional (2D) PbTe monolayers as newly fabricated thermoelectric
materials have sparked great interest due to their excellent physical properties, which are …

Diamond substrate with superior thermal conductivity has been the most promising heat sink
to solve the heat dissipation issues in GaN-based power electronics. The phonon transport …

The development of emerging technologies, such as quantum computing and
semiconductor electronics, emphasizes the growing significance of thermal management at …

Cu− diamond composites (CDCs) have greatly promising applications in thermal
management for high-power electronics because of their outstanding thermophysical …

Phosphorus has diverse chemical bonds, and even in its two-dimensional form, there are
three stable allotropes: black phosphorene (Black-P), blue phosphorene (Blue-P), and violet …

The melting thermodynamic characteristics of 2-to 20-layered onion-like fullerenes (OLF
n)(C 60@ C 240 to C 60@···@ C 6000···@ C 24000) are comprehensively explored using …

The thermal transport properties of five-fold twinned (5FT) germanium–silicon (Ge–Si)
heteronanowires (h-NWs) with varying cross-sectional areas, germanium (Ge) domain ratios …

The thermal conductivity of nanostructures can be obtained using atomistic classical
Molecular Dynamics (MD) simulations, particularly for semiconductors where there is no …