Extending the σ-hole concept to metals: An electrostatic interpretation of the effects of nanostructure in gold and platinum catalysis JH Stenlid, T Brinck Journal of the American Chemical Society 139 (32), 11012-11015, 2017 | 155 | 2017 |
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 | 108 | 2018 |
Key activity descriptors of nickel-iron oxygen evolution electrocatalysts in the presence of alkali metal cations M Görlin, J Halldin Stenlid, S Koroidov, HY Wang, M Börner, M Shipilin, ... Nature communications 11 (1), 6181, 2020 | 92 | 2020 |
The state of zinc in methanol synthesis over a Zn/ZnO/Cu (211) model catalyst P Amann, B Klötzer, D Degerman, N Köpfle, T Götsch, P Lömker, ... Science 376 (6593), 603-608, 2022 | 84 | 2022 |
Tying different knots in a molecular strand DA Leigh, F Schaufelberger, L Pirvu, JH Stenlid, DP August, J Segard Nature 584, 562-568, 2020 | 74 | 2020 |
Trends in oxygenate/hydrocarbon selectivity for electrochemical CO(2) reduction to C2 products HJ Peng, MT Tang, J Halldin Stenlid, X Liu, F Abild-Pedersen Nature communications 13 (1), 1399, 2022 | 58 | 2022 |
Ab initio cyclic voltammetry on Cu (111), Cu (100) and Cu (110) in acidic, neutral and alkaline solutions A Bagger, RM Arán‐Ais, J Halldin Stenlid, E Campos dos Santos, ... ChemPhysChem 20 (22), 3096-3105, 2019 | 57 | 2019 |
The Molecular Surface Property Approach: A Guide to Chemical Interactions in Chemistry, Medicine, and Material Science T Brinck, J H. Stenlid Advanced Theory and Simulations, 1800149, 2018 | 54 | 2018 |
The Surface Structure of Cu2O(100) M Soldemo, JH Stenlid, Z Besharat, M Ghadami Yazdi, A Onsten, ... The Journal of Physical Chemistry C 120 (8), 4373-4381, 2016 | 53 | 2016 |
Nucleophilic aromatic substitution reactions described by the local electron attachment energy JH Stenlid, T Brinck The Journal of Organic Chemistry 82 (6), 3072-3083, 2017 | 51 | 2017 |
The Role of Roughening to Enhance Selectivity to C2+ Products during CO2 Electroreduction on Copper JA Gauthier, JH Stenlid, F Abild-Pedersen, M Head-Gordon, AT Bell ACS Energy Letters 6 (9), 3252-3260, 2021 | 49 | 2021 |
Mechanism and regioselectivity of electrophilic aromatic nitration in solution: the validity of the transition state approach M Liljenberg, JH Stenlid, T Brinck Journal of Molecular Modeling 24, 1-13, 2018 | 44 | 2018 |
Dehydrogenation of methanol on Cu2O (100) and (111) Z Besharat, J Halldin Stenlid, M Soldemo, K Marks, A Önsten, M Johnson, ... The Journal of chemical physics 146 (24), 2017 | 37 | 2017 |
Catalytic Performance and Near-Surface X-ray Characterization of Titanium Hydride Electrodes for the Electrochemical Nitrate Reduction Reaction MJ Liu, J Guo, AS Hoffman, JH Stenlid, MT Tang, ER Corson, KH Stone, ... Journal of the American Chemical Society 144 (13), 5739-5744, 2022 | 36 | 2022 |
Local electron attachment energy and its use for predicting nucleophilic reactions and halogen bonding T Brinck, P Carlqvist, JH Stenlid The Journal of Physical Chemistry A 120 (50), 10023-10032, 2016 | 35 | 2016 |
Theoretical investigation into rate-determining factors in electrophilic aromatic halogenation M Liljenberg, JH Stenlid, T Brinck The Journal of Physical Chemistry A 122 (12), 3270-3279, 2018 | 33 | 2018 |
Vernier template synthesis of molecular knots Z Ashbridge, E Kreidt, L Pirvu, F Schaufelberger, JH Stenlid, ... Science 375 (6584), 1035-1041, 2022 | 32 | 2022 |
Nanoscale Spatial Distribution of Supported Nanoparticles Controls Activity and Stability in Powder Catalysts for CO Oxidation and Photocatalytic H2 Evolution A Holm, ED Goodman, JH Stenlid, A Aitbekova, R Zelaya, BT Diroll, ... Journal of the American Chemical Society 142 (34), 14481-14494, 2020 | 30 | 2020 |
Modeling potential-dependent electrochemical activation barriers: revisiting the alkaline hydrogen evolution reaction J Li, JH Stenlid, T Ludwig, PS Lamoureux, F Abild-Pedersen Journal of the American Chemical Society 143 (46), 19341-19355, 2021 | 29 | 2021 |
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 |