Search Results for author: Davide Donadio

Found 2 papers, 1 papers with code

Efficient Anharmonic Lattice Dynamics Calculations of Thermal Transport in Crystalline and Disordered Solids

1 code implementation4 Sep 2020 Giuseppe Barbalinardo, Zekun Chen, Nicholas W. Lundgren, Davide Donadio

Understanding heat transport in semiconductors and insulators is of fundamental importance because of its technological impact in electronics and renewable energy harvesting and conversion.

Materials Science Applied Physics

Influence of Boundaries and Thermostatting on Nonequilibrium Molecular Dynamics Simulations of Heat Conduction in Solids

no code implementations27 May 2019 Zhen Li, Shiyun Xiong, Charles Sievers, Yue Hu, Zheyong Fan, Ning Wei, Hua Bao, Shunda Chen, Davide Donadio, Tapio Ala-Nissila

Conventionally, the thermal conductivity of a finite system is calculated as the ratio between the heat flux and the temperature gradient extracted from the linear part of the temperature profile away from the local thermostats.

Mesoscale and Nanoscale Physics Statistical Mechanics Computational Physics

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