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How to Compute the Fukui Matrix and Function for Systems with (Quasi-)Degenerate States
(American Chemical Society, 2014)
Predicting deprotonation sites using alchemical derivatives
(American Chemical Society, 2020)
Interaction of Nitroxide Radicals with an Au8 Nanostructure: Theoretical and Calorimetric Studies
(American Chemical Society, 2019)
Boron avoids cycloalkane-like structures in the LinBnH2n series
(Royal Society of Chemestry, 2016)
Understanding chemical reactivity in extended systems: exploring models of chemical softness in carbon nanotubes
(Peking University Press, 2018)