Exploring Compositional and Configurational Chemical Space with Explainable AI

Alexandre Tkatchenko
March 29, 2024

Bridging Scales in Materials Modeling With Occam-Shaved Machine Learning

Luca Ghiringhelli
March 29, 2024

Harnessing The Properties of Equivariant Neural Networks To Understand And Design Atomic Systems

Tess Smidt
March 29, 2024

Extrapolating Unconverged GW Energies up to the Complete Basis Set Limit with a Linear Model

Fabien Bruneval
March 28, 2024

Expressing The Density Matrix as Functional Of The Density: How To Profit From Machine Learning?

Lucia Reining
March 28, 2024

Theory-informed AI/ML for Microscopy & Spectroscopy (tentative)

Maria Chan
March 28, 2024

Deep Variational Quantum Monte Carlo – a way forward for strongly correlated systems?

Frank Noé
March 27, 2024

Neural Quantum States For Ab Initio Many-Body Electronic Problems

Giuseppe Carleo
March 27, 2024

Representation Of Symmetric and Antisymmetric Functions

Jianfeng Lu
March 27, 2024