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15–18 Oct 2024
Purdue University
America/Indiana/Indianapolis timezone

[Remote] Machine learning and electronic structure calculation in materials and beyond

15 Oct 2024, 11:20
35m
Steward Center 306 (Third floor) (Purdue University)

Steward Center 306 (Third floor)

Purdue University

128 Memorial Mall Dr, West Lafayette, IN 47907

Speaker

Kieron Burke

Description

I will briefly outline the huge importance of density functional theory (DFT) calculations
to modern materials design (and to chemistry and warm dense matter, etc). I will then
discuss the impact of machine learning on the field, especially the rise of machine-learned
potentials. I will briefly mention my own work in using ML to improve DFT.

Presentation materials