Fullerene Rotational Dynamics Generate Disordered Configurations That Suppress Thermal Conductivity in Superatomic Crystals

Nanoscale Horiz., 2020, Accepted Manuscript
DOI: 10.1039/D0NH00358A, Communication

Qi Liang, Matthew Bartnof, Ya-Ling He, Jonathan A Malen, Alan McGaughey
The thermal conductivity of fullerene-based superatomic crystals (SACs) is investigated using molecular dynamics simulations. The temperature-dependent predictions agree with the trends of previous measurements. The thermal conductivity behavior emerges as...
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