@article{catalystgflownetforelectrocatalystdesign, title = {Catalyst GFlowNet for electrocatalyst design: A hydrogen evolution reaction case study}, author = {Lena Podina and Christina Humer and Alexandre Duval and Victor Schmidt and Ali Ramlaoui and Shahana Chatterjee and Yoshua Bengio and Alex Hernandez-Garcia and David Rolnick and Félix Therrien}, year = {2025}, eprint = {2510.02142}, archivePrefix = {arXiv}, url = {https://arxiv.org/abs/2510.02142}, }