145 citations · 230 across the 7 of their papers we have counts for
4 papers · 1 filter
Multi-objective Generative Design of Three-Dimensional Composite Materials
Zhengyang Zhang, Han Fang, Zhao Xu +3
Composite materials with 3D architectures are desirable in a variety of applications for the capability of tailoring their properties to meet multiple functional requirements. By t…
Revealing atomistic mechanisms of gold-catalyzed germanium growth using molecular dynamics simulations
Zhiyi Wang, Jixin Wu, Yanming Wang
The vapor-liquid-solid (VLS) method is considered a plausible technique for synthesizing germanium (Ge) nanostructures (e.g. nanowires), which have a broad range of applications du…
Accelerating amorphous polymer electrolyte screening by learning to reduce errors in molecular dynamics simulated properties
Tian Xie, Arthur France-Lanord, Yanming Wang +8
Polymer electrolytes are promising candidates for the next generation lithium-ion battery technology. Large scale screening of polymer electrolytes is hindered by the significant c…
Graph Dynamical Networks for Unsupervised Learning of Atomic Scale Dynamics in Materials
Tian Xie, Arthur France-Lanord, Yanming Wang +2
Understanding the dynamical processes that govern the performance of functional materials is essential for the design of next generation materials to tackle global energy and envir…