A computational study on the intriguing mechanisms of the gas-phase thermal activation of methane by bare [Ni(H)(OH)]+
Phys. Chem. Chem. Phys. 2012, 14, 9306-9310.
Mild, reversible reaction of iridium(III) amido complexes with carbon dioxide
Inorg. Chem. 2012, 51, 9683-9693.
Merging sustainability with organocatalysis in the formation of organic carbonates by using CO2 as a feedstock
ChemSusChem 2012, 5, 2032-2038.
The role of cyclobutenes in gold(I)-catalysed skeletal rearrangement of 1,6-enynes
Org. Biomol. Chem. 2012, 10, 6105-6111.
Synthesis of PCP-supported nickel complexes and their reactivity with carbon dioxide
Chem. Eur. J. 2012, 18, 6915-6927.
Transition metal catalysis by Density Functional Theory and Density Functional Theory/Molecular Mechanics
WIREs Comput. Mol. Sci. 2012, 2, 375-385.
Substitution reactions in dinuclear Ru-Hbpp complexes: An evaluation of through-space interactions
Inorg. Chem. 2012, 51, 1889-1901.