CMSP Seminar (Atomistic Simulation Webinar Series): Combining molecular modelling and machine learning to explore structure and dynamics of materials in bulk and at interfaces
In this talk, I will present some recent advancements in modelling structure and dynamics in interfacial water. Furthermore, I will discuss how machine learning can be of help to understand and predict the properties of interfaces and bulks at the atomic scale, sidestepping much of the human and computational cost typically required by modelling studies.