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cond-mat.mtrl-sci2019
Computational prediction of lattice thermal conductivity -- a comparison of molecular dynamics and Boltzmann transport approaches
Marcello Puligheddu, Yi Xia, Maria K. Y. Chan +1
The predictive modeling of lattice thermal conductivity is of fundamental importance for the understanding and design of materials for a wide range of applications. Two major appro…
cond-mat.mtrl-sci2015★ 64 cited
Thermal boundary resistance at Si/Ge interfaces determined by approach-to-equilibrium molecular dynamics simulations
Konstanze R. Hahn, Marcello Puligheddu, Luciano Colombo
The thermal boundary resistance of Si/Ge interfaces as been determined using approach-to-equilibrium molecular dynamics simulations. Assuming a reciprocal linear dependence of the…