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Determination of thermal conductivity coefficient by Green-Kubo formula using the minimum image method

Hyżorek Krzysztof, Ciesielczyk Karol, Tretiakov Konstantin V.

The thermal conductivity coefficients of solid argon have been evaluated by equilibrium molecular dynamic simulations. A Lennard-Jones interatomic potential has been used to model the interactions between argon atoms. In simulations and calculations of the thermal conductivity by the Green-Kubo f ...