Thermal Conductivity of Liquid Water from Reverse Nonequilibrium Ab Initio Molecular Dynamics
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DOI: 10.7566/jpsj.87.025001
Abstract: We report on a theoretical framework for calculating the thermal conductivity of liquid water from first principles with the aid of the linear scaling method. We also discuss the possibility of obtaining equilibrium properties from… read more here.
Keywords: thermal conductivity; liquid water; conductivity liquid; water reverse ... See more keywords