190 citations · 2.3k across the 53 of their papers we have counts for
53 papers
ALATDYN: a set of Anharmonic LATtice DYNamics codes to compute thermodynamic and thermal transport properties of crystalline solids
Keivan Esfarjani, Harold Stokes, Safoura Nayeb Sadeghi +6
We introduce a lattice dynamics package which calculates elastic, thermodynamic and thermal transport properties of crystalline materials from data on their force and potential ene…
Electron-phonon coupling and non-equilibrium thermal conduction in ultrafast heating systems
Chuang Zhang, Rulei Guo, Meng Lian +1
The electron-phonon coupling in ultrafast heating systems is studied within the framework of Boltzmann transport equation (BTE) with coupled electron and phonon transport. A discre…
RadonPy: Automated Physical Property Calculation using All-atom Classical Molecular Dynamics Simulations for Polymer Informatics
Yoshihiro Hayashi, Junichiro Shiomi, Junko Morikawa +1
The rapid growth of data-driven materials research has made it necessary to develop systematically designed, open databases of material properties. However, there are few open data…
Phase-transition-induced giant Thomson effect for thermoelectric cooling
Rajkumar Modak, Masayuki Murata, Dazhi Hou +7
The Seebeck and Peltier effects have been widely studied and used in various thermoelectric technologies, including thermal energy harvesting and solid-state heat pumps. However, b…
Descriptors of intrinsic hydrodynamic thermal transport: screening a phonon database in a machine learning approach
Pol Torres, Stephen Wu, Shenghong Ju +4
Machine learning techniques are used to explore the intrinsic origins of the hydrodynamic thermal transport and to find new materials interesting for science and engineering. The h…
Machine Learning-Assisted Exploration of Thermally Conductive Polymers Based on High-Throughput Molecular Dynamics Simulations
Ruimin Ma, Hanfeng Zhang, Jiaxin Xu +4
Finding amorphous polymers with higher thermal conductivity is important, as they are ubiquitous in heat transfer applications. With recent progress in material informatics, machin…