2 papers
cond-mat.mtrl-sci2026
Probabilistic Deep Learning Framework for Phase Transformation Forecasting aided by In Situ High temperature Microscopy
Ioannis Kouroudis, Niki Balestrieri, Stefan Rotzsche +3
The mechanical performance of structural materials is governed by their microstructure, which is itself set by the thermal history imposed during processing. Predicting how that mi…
physics.chem-ph2024
AUGUR, A flexible and efficient optimization algorithm for identification of optimal adsorption sites
Ioannis Kouroudis, Poonam, Neel Misciaci +4
In this paper, we propose a novel flexible optimization pipeline for determining the optimal adsorption sites, named AUGUR (Aware of Uncertainty Graph Unit Regression). Our model c…