Search Results for author: Maira de Bayser

Found 2 papers, 0 papers with code

Prediction of $\textrm{CO}_2$ Adsorption in Nano-Pores with Graph Neural Networks

no code implementations22 Aug 2022 Guojing Cong, Anshul Gupta, Rodrigo Neumann, Maira de Bayser, Mathias Steiner, Breanndán Ó Conchúir

We investigate the graph-based convolutional neural network approach for predicting and ranking gas adsorption properties of crystalline Metal-Organic Framework (MOF) adsorbents for application in post-combustion capture of $\textrm{CO}_2$.

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