Massimiliano Lupo Pasini, Marko Burcul, Samuel Temple Reeve, Markus Eisenbach 0002, Simona Perotto. Fast and Accurate Predictions of Total Energy for Solid Solution Alloys with Graph Convolutional Neural Networks. In Jeffrey Nichols, Arthur Barney Maccabe, James J. Nutaro, Swaroop Pophale, Pravallika Devineni, Theresa Ahearn, Becky Verastegui, editors, Driving Scientific and Engineering Discoveries Through the Integration of Experiment, Big Data, and Modeling and Simulation - 21st Smoky Mountains Computational Sciences and Engineering, SMC 2021, Virtual Event, October 18-20, 2021, Revised Selected Papers. Volume 1512 of Communications in Computer and Information Science, pages 79-98, Springer, 2021. [doi]
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