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Items where Author is "Lledós, Agustí"
Group by: Item Type | No Grouping Jump to: Article Number of items: 2. ArticleSciortino, Giuseppe and Lihi, Norbert and Czine, Tamás and Marechal, Jean-Didier and Lledós, Agustí (2018) Accurate prediction of vertical electronic transitions of Ni(II) coordination compounds via time dependent density functional theory. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 118 (16). pp. 1-23. ISSN 0020-7608 Stirling, András and Nair, Nisanth N. and Lledós, Agustí and Ujaque, Gregori (2014) Challenges in modelling homogeneous catalysis : new answers from ab initio molecular dynamics to the controversy over the Wacker process. CHEMICAL SOCIETY REVIEWS, 43 (14). pp. 4940-4952. ISSN 0306-0012 |
