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Molecules (Basel, Switzerland)|October 26, 2024
Electron Density and Molecular Orbital Analyses of the Nature of Bonding in the η3-CCH Agostic Rhodium Complexes Preceding the C-C and C-H Bond CleavagesIrena EfremenkoThe Journal of Physical Chemistry. A|April 22, 2011
Protonation of phosphovanadomolybdates H(3+x)PV(x)Mo(12-x)O40: computational insight into reactivityIrena Efremenko, Ronny NeumannLangmuir : the ACS Journal of Surfaces and Colloids|June 29, 2005
Enthalpy and entropy effects in hydrogen adsorption on carbon nanotubesIrena Efremenko, Moshe SheintuchLangmuir : the ACS Journal of Surfaces and Colloids|April 6, 2006
Predicting solute adsorption on activated carbon: phenolIrena Efremenko, Moshe SheintuchJournal of the American Chemical Society|December 6, 2012
Computational insight into the initial steps of the Mars-van Krevelen mechanism: electron transfer and surface defects in the reduction of polyoxometalatesIrena Efremenko, Ronny NeumannThe Journal of Physical Chemistry. A|September 29, 2021
Coupled Cluster Benchmark of New DFT and Local Correlation Methods: Mechanisms of Hydroarylation and Oxidative Coupling Catalyzed by Ru(II, III) Chloride CarbonylsIrena Efremenko, Jan M L MartinJournal of the American Chemical Society|April 23, 2015
Oxygenation of methylarenes to benzaldehyde derivatives by a polyoxometalate mediated electron transfer-oxygen transfer reaction in aqueous sulfuric AcidBidyut Bikash Sarma, Irena Efremenko, Ronny NeumannJournal of the American Chemical Society|October 1, 2010
DFT study of the structure and reactivity of the terminal Pt(IV)-oxo complex bearing no electron-withdrawing ligandsIrena Efremenko, Elena Poverenov, Jan M L Martin, et al.Dalton Transactions (Cambridge, England : 2003)|August 8, 2009
A DFT study on the mechanism of a novel, regioselective, intramolecular N-pi rearrangement of cis and trans-eta1-N-Cp*Rh-hydroxytamoxifen complexes to their eta6 derivatives; potential breast cancer pharmaceuticals, and fluorescent probesIrena Efremenko, Siden Top, Jan M L Martin, et al.Angewandte Chemie (International Ed. in English)|March 27, 2024
Calcium-Ligand Cooperation Promoted Activation of N2O, Amine, and H2 as well as Catalytic Hydrogenation of Imines, Quinoline, and AlkenesYaoyu Liang, Irena Efremenko, Yael Diskin-Posner, et al.Pageof 3