49 citations · 55 across the 8 of their papers we have counts for
4 papers · 1 filter
Lattice-to-Total Thermal Conductivity Ratio: A Phonon-Glass Electron-Crystal Descriptor for Data-Driven Thermoelectric Design
Yifan Sun, Zhi Li, Tetsuya Imamura +3
Thermoelectrics (TEs) are promising candidates for energy harvesting with performance quantified by figure of merit, . To accelerate the discovery of high- materials, effor…
Origin of Glass-like Thermal Conductivity in Crystalline TlAgTe
Shantanu Semwal, Yi Xia, Chris Wolverton +1
Ordered crystalline compounds exhibiting ultralow and glass-like thermal conductivity are both fundamentally and technologically important, where phonon quasi-particles dominate th…
Interpretable Nanoporous Materials Design with Symmetry-Aware Networks
Zhenhao Zhou, Salman Bin Kashif, Jin-Hu Dou +4
Reticular frameworks hold promise for diverse sustainable applications, yet their immense chemical space limits efficient and systematic design. While machine learning provides a c…
High-throughput computational framework for lattice dynamics and thermal transport including high-order anharmonicity: an application to cubic and tetragonal inorganic compounds
Zhi Li, Huiju Lee, Chris Wolverton +1
Accurately predicting lattice thermal conductivity (kL) from first principles remains a challenge in identifying materials with extreme thermal behavior. While modern lattice dynam…