Research Labs

Laboratory of Materials Modeling and Simulations (LMMS)



LMMS foucses on development and application of advanced multi-scale modeling methods, in conjuction with machine learning algorithms, toward accerlating the optimization and realizaiton of novel functional materials. Our current research covers a wide range of materials, including low-dimensional materials, energy materials, carbonaceous materials and etc., with special interests in scientfic problems related to phase transition, interface, transport and mechanical behaviors.