681 citations · 2.1k across the 20 of their papers we have counts for
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cond-mat.mtrl-sci2018★ 51 cited
The key role of antibonding electron transfer in surface chemisorption and heterogeneous catalysis
Liping Yu, Qimin Yan, Adrienn Ruzsinszky
The description of the chemical bond between a solid surface and an atom or a molecule is the fundamental basis for understanding a broad range of scientific problems in heterogene…
physics.comp-ph2018★ 204 cited
Atom2Vec: learning atoms for materials discovery
Quan Zhou, Peizhe Tang, Shenxiu Liu +3
Exciting advances have been made in artificial intelligence (AI) during the past decades. Among them, applications of machine learning (ML) and deep learning techniques brought hum…