Mechanism of H2O2 Decomposition on Transition Metal Oxide Surfaces CM Lousada, AJ Johansson, T Brinck, M Jonsson The Journal of Physical Chemistry C 116 (17), 9533-9543, 2012 | 284 | 2012 |
σ-Holes and σ-lumps direct the Lewis basic and acidic interactions of noble metal nanoparticles: Introducing regium bonds JH Stenlid, AJ Johansson, T Brinck Physical Chemistry Chemical Physics 20 (4), 2676-2692, 2018 | 111 | 2018 |
Mechanistic Insights into Copper‐Catalyzed Sonogashira–Hagihara‐Type Cross‐Coupling Reactions: Sub‐Mol% Catalyst Loadings and Ligand Effects LH Zou, AJ Johansson, E Zuidema, C Bolm Chemistry–A European Journal 19 (25), 8144-8152, 2013 | 92 | 2013 |
Reactivity of metal oxide clusters with hydrogen peroxide and water–a DFT study evaluating the performance of different exchange–correlation functionals CM Lousada, AJ Johansson, T Brinck, M Jonsson Physical Chemistry Chemical Physics 15 (15), 5539-5552, 2013 | 87 | 2013 |
Corrosion of copper in pure O2-free water? A Hedin, AJ Johansson, C Lilja, M Boman, P Berastegui, R Berger, ... Corrosion Science, 2018 | 65 | 2018 |
Quantum chemical modeling of the oxidation of dihydroanthracene by the biomimetic nonheme iron catalyst [(TMC)FeIV(O)]2+ AJ Johansson, MRA Blomberg, PEM Siegbahn The Journal of Physical Chemistry C 111 (33), 12397-12406, 2007 | 59 | 2007 |
On the Mechanism of Ruthenium‐Catalyzed Formation of Hydrogen from Alcohols: A DFT Study AJ Johansson, E Zuidema, C Bolm Chemistry–A European Journal 16 (45), 13487-13499, 2010 | 40 | 2010 |
Quantifying the effects of the self-interaction error in density functional theory: When do the delocalized states appear? II. Iron-oxo complexes and closed-shell substrate … AJ Johansson, MRA Blomberg, PEM Siegbahn The Journal of chemical physics 129 (15), 2008 | 40 | 2008 |
Thermodynamics of H2O splitting and H2 formation at the Cu(110)–water interface CM Lousada, AJ Johansson, PA Korzhavyi The Journal of Physical Chemistry C 119 (25), 14102-14113, 2015 | 39 | 2015 |
Theoretical insights into heme-catalyzed oxidation of cyclohexane to adipic acid H Noack, V Georgiev, MRA Blomberg, PEM Siegbahn, AJ Johansson Inorganic Chemistry 50 (4), 1194-1202, 2011 | 37 | 2011 |
Mechanistic insights into the stepwise Diels–Alder reaction of 4,6-dinitrobenzofuroxan M Linder, AJ Johansson, T Brinck Organic letters 14 (1), 118-121, 2011 | 31 | 2011 |
On the formation of hydrogen gas on copper in anoxic water AJ Johansson, C Lilja, T Brinck The Journal of chemical physics 135 (8), 2011 | 30 | 2011 |
In situ evaluation of model copper-cast iron canisters for spent nuclear fuel: a case of microbiologically influenced corrosion (MIC) NR Smart, AP Rance, B Reddy, L Hallbeck, K Pedersen, AJ Johansson Corrosion engineering, science and technology 49 (6), 548-553, 2014 | 28 | 2014 |
Searching for the thermodynamic limit–a DFT study of the step-wise water oxidation of the bipyramidal Cu7 cluster JH Stenlid, AJ Johansson, T Brinck Physical Chemistry Chemical Physics 16 (6), 2452-2464, 2014 | 27 | 2014 |
Reactivity at the Cu2O(100):Cu–H2O interface: a combined DFT and PES study JH Stenlid, M Soldemo, AJ Johansson, C Leygraf, M Göthelid, ... Physical Chemistry Chemical Physics 18 (44), 30570-30584, 2016 | 23 | 2016 |
Molecular and dissociative adsorption of water and hydrogen sulfide at perfect and defective Cu (110) surfaces CM Lousada, AJ Johansson, PA Korzhavyi Physical Chemistry Chemical Physics 19 (11), 8111-8120, 2017 | 22 | 2017 |
Structure and Bonding of the Manganese(II)Phosphide Complex (t-BuPH2)(η5-Cp)Mn{μ-(t-BuPH)}2Mn(Cp)(t-BuPH2) FA Stokes, RJ Less, J Haywood, RL Melen, RI Thompson, AEH Wheatley, ... Organometallics 31 (1), 23-26, 2011 | 22 | 2011 |
Designing a New Diels–Alderase: A Combinatorial, Semirational Approach Including Dynamic Optimization. M Linder, AJ Johansson, TSG Olsson, J Liebeschuetz, T Brinck Journal of chemical information and modeling 51 (8), 1906-1917, 2011 | 21 | 2011 |
σ-Holes on transition metal nanoclusters and their influence on the local Lewis acidity JH Stenlid, AJ Johansson, T Brinck Crystals 7 (7), 222, 2017 | 19 | 2017 |
The Nature of the Copper Sulphide Film Grown on Copper in Aqueous Sulphide and Chloride Solutions M Guo, J Chen, T Martino, C Lilja, AJ Johansson, M Behazin, WJ Binns, ... Materials and Corrosion, 2020 | 18* | 2020 |