Atomically precise, thiolated copper–hydride nanoclusters as single-site hydrogenation catalysts for ketones in mild conditions C Sun, N Mammen, S Kaappa, P Yuan, G Deng, C Zhao, J Yan, S Malola, ... ACS nano 13 (5), 5975-5986, 2019 | 142 | 2019 |
Tuning the morphology of gold clusters by substrate doping N Mammen, S Narasimhan, S de Gironcoli Journal of the American Chemical Society 133 (9), 2801-2803, 2011 | 66 | 2011 |
Towards atomically precise supported catalysts from monolayer‐protected clusters: the critical role of the support A Longo, EJJ de Boed, N Mammen, M van der Linden, K Honkala, ... Chemistry–A European Journal 26 (31), 7051-7058, 2020 | 23 | 2020 |
Reversing Size‐Dependent Trends in the Oxidation of Copper Clusters through Support Effects N Mammen, L Spanu, EC Tyo, B Yang, A Halder, S Seifert, MJ Pellin, ... European Journal of Inorganic Chemistry 2018 (1), 16-22, 2018 | 20 | 2018 |
Elastic displacements and step interactions on metallic surfaces: Grazing-incidence x-ray diffraction and ab initio study of Au (332) G Prévot, Y Girard, V Repain, S Rousset, A Coati, Y Garreau, J Paul, ... Physical Review B 81 (7), 075415, 2010 | 19 | 2010 |
Non-FCC rich Au crystallites exhibiting unusual catalytic activity G Mettela, N Mammen, J Joardar, S Narasimhan, GU Kulkarni Nano Research 10, 2271-2279, 2017 | 16 | 2017 |
Addressing dynamics at catalytic heterogeneous interfaces with DFT-MD: anomalous temperature distributions from commonly used thermostats V Korpelin, T Kiljunen, MM Melander, MA Caro, HH Kristoffersen, ... The Journal of Physical Chemistry Letters 13 (11), 2644-2652, 2022 | 14 | 2022 |
Using first principles calculations to interpret XANES experiments: extracting the size-dependence of the (p, T) phase diagram of sub-nanometer Cu clusters in an O2 environment N Mammen, L Spanu, EC Tyo, B Yang, A Halder, S Seifert, MJ Pellin, ... Journal of Physics: Condensed Matter 31 (14), 144002, 2019 | 12 | 2019 |
Substrate doping: A strategy for enhancing reactivity on gold nanocatalysts by tuning sp bands N Mammen, S de Gironcoli, S Narasimhan The Journal of Chemical Physics 143 (14), 2015 | 10 | 2015 |
Trends in the electronic structure of extended gold compounds: Implications for use of gold in heterogeneous catalysis MS Miao, JA Kurzman, N Mammen, S Narasimhan, R Seshadri Inorganic Chemistry 51 (14), 7569-7578, 2012 | 9 | 2012 |
Computational Criteria for Hydrogen Evolution Activity on Ligand-Protected Au25-Based Nanoclusters O López-Estrada, N Mammen, L Laverdure, MM Melander, H Häkkinen, ... ACS Catalysis 13 (13), 8997-9006, 2023 | 7 | 2023 |
Dynamics of weak interactions in the ligand layer of meta-mercaptobenzoic acid protected gold nanoclusters Au 68 (m-MBA) 32 and Au 144 (m-MBA) 40 N Mammen, S Malola, K Honkala, H Häkkinen Nanoscale 12 (46), 23859-23868, 2020 | 7 | 2020 |
Inducing wetting morphologies and increased reactivities of small Au clusters on doped oxide supports N Mammen, S Narasimhan The Journal of Chemical Physics 149 (17), 2018 | 7 | 2018 |
Selective acrolein hydrogenation over ligand-protected gold clusters: a Venus flytrap mechanism N Mammen, S Malola, K Honkala, H Häkkinen ACS Catalysis 12 (4), 2365-2374, 2022 | 6 | 2022 |
Enhanced hydrogen evolution reactivity on – composites D Acharya, K Ojha, N Mammen, P Dagar, S Mondal, AK Ganguli, ... Bulletin of Materials Science 43, 1-13, 2020 | 6 | 2020 |
Descriptor for the efficacy of aliovalent doping of oxides and its application for the charging of supported Au clusters S Ghosh, N Mammen, S Narasimhan The Journal of Physical Chemistry C 123 (32), 19794-19805, 2019 | 5 | 2019 |
Support work function as a descriptor and predictor for the charge and morphology of deposited Au nanoparticles S Ghosh, N Mammen, S Narasimhan The Journal of Chemical Physics 152 (14), 2020 | 4 | 2020 |
Diffusion barriers, growth pathways, and scaling relations for small supported metal clusters N Mammen, S Narasimhan The Journal of Chemical Physics 151 (14), 2019 | 3 | 2019 |
Binding Behavior of Carbonmonoxide to Gold Atoms on Ag (001) D Kuhness, J Pal, HJ Yang, N Mammen, K Honkala, H Häkkinen, ... Topics in Catalysis 63 (15), 1578-1584, 2020 | 1 | 2020 |
Addressing Dynamics at Catalytic Heterogeneous Interfaces with DFT-MD V Korpelin, T Kiljunen, MM Melander, MA Caro, HH Kristoffersen, ... AMERICAN CHEMICAL SOCIETY, 2022 | | 2022 |