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Maria Chiara Storer, Katarzyna J Zator, Derek P Reynolds, Christopher A Hunter. An atomic surface site interaction point description of non-covalent interactions.Chemical science. 2023, 15 (1): 160-170
Charlie Ruffman, Krista G Steenbergen, Anna L Garden, Nicola Gaston. Dynamic sampling of liquid metal structures for theoretical studies on catalysis.Chemical science. 2023, 15 (1): 185-194
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