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| | | Issue Date | Title | Author(s) | Type |
| 1 | | 2020 | Role of Oxidized Mo Species on the Active Surface of Ni–Mo Electrocatalysts for Hydrogen Evolution under Alkaline Conditions | Bau, Jeremy A.; Kozlov, Sergey M.; Azofra Mesa, Luis Miguel ; Ould-Chikh, Samy; Emwas, Abdul-Hamid; Idriss, Hicham; Cavallo, Luigi; Takanabe, Kazuhiro | Artículo |  |
| 2 | | 2020 | σ/π Plasticity of NHCs on the Ruthenium–Phosphine and Ruthenium═Ylidene Bonds in Olefin Metathesis Catalysts | Azofra Mesa, Luis Miguel ; Vummaleti, Sai V. C.; Zhang, Ziyun; Poater, Albert; Cavallo, Luigi | Artículo |  |
| 3 | | 2020 | Conversion of racemic alcohols to optically pure amine precursors enabled by catalyst dynamic kinetic resolution: experiment and computation | Azofra Mesa, Luis Miguel ; Tran, Mai Anh; Zubar, Viktoriia; Cavallo, Luigi; Rueping, Magnus; El-Sepelgy, Osama | Artículo |  |
| 4 | | 2020 | Liquefied Sunshine: Transforming Renewables into Fertilizers and Energy Carriers with Electromaterials | MacFarlane, Douglas R.; Choi, Jaecheol; Suryanto, Bryan H. R.; Jalili, Rouhollah; Chatti, Manjunath; Azofra Mesa, Luis Miguel ; Simonov, Alexandr N. | Artículo |  |
| 5 | | 2020 | Shedding Light on the Interfacial Structure of Low-Coverage Alkanethiol Lattices | Pensa, Evangelina; Azofra Mesa, Luis Miguel ; Albrecht, Tim; Salvarezza, Roberto C.; Carro, Pilar | Artículo |  |
| 6 | | 2020 | Manganese-Catalyzed Regioselective Dehydrogenative C- versus N-Alkylation Enabled by a Solvent Switch: Experiment and Computation | Borghs, Jannik C.; Zubar, Viktoriia; Azofra Mesa, Luis Miguel ; Sklyaruk, Jan; Rueping, Magnus | Artículo |  |
| 7 | | 2020 | Stabilisation of dianion dimers trapped inside cyanostar macrocycles | Azofra Mesa, Luis Miguel ; Elguero, José; Alkorta, Ibon | Artículo |  |
| 8 | | 2020 | In silico design of novel NRR electrocatalysts: cobalt–molybdenum alloys | Castellano-Varona, Blanca; Harb, Moussab; Araña Mesa, Francisco Javier ; Cavallo, Luigi; Azofra Mesa, Luis Miguel | Artículo |  |
| 9 | | 2020 | A conceptual DFT study of phosphonate dimers: dianions supported by H-Bonds | Azofra Mesa, Luis Miguel ; Elguero, José; Alkorta, Ibon | Artículo |  |
| 10 | | 2019 | Manganese‐Catalyzed Multicomponent Synthesis of Pyrroles through Acceptorless Dehydrogenation Hydrogen Autotransfer Catalysis: Experiment and Computation | Borghs, Jannik C.; Azofra Mesa, Luis Miguel ; Biberger, Tobias; Linnenberg, Oliver; Cavallo, Luigi; Rueping, Magnus; El‐Sepelgy, Osama | Artículo | |
| 11 | | 2019 | Quantifying electronic similarities between NHC-gold(i) complexes and their isolobal imidazolium precursors | Azofra Mesa, Luis Miguel ; Veenboer, Richard M. P.; Falivene, Laura; Vummaleti, Sai V. C.; Poater, Albert; Nolan, Steven P.; Cavallo, Luigi | Artículo |  |
| 12 | | 2019 | Regression analysis of properties of [Au(IPr)(CHR2)] complexes | Veenboer, Richard M. P.; Azofra Mesa, Luis Miguel ; Gasperini, Danila; Collado, Alba; Cordes, David B.; Slawin, Alexandra M. Z.; Cavallo, Luigi; Nolan, Steven P. | Artículo |  |
| 13 | | 2019 | Unravelling the reaction mechanism for the Claisen-Tishchenko condensation catalysed by Mn(I)-PNN complexes: a DFT study | Azofra Mesa, Luis Miguel ; Cavallo, Luigi | Artículo |  |
| 14 | | 2019 | Diastereoselective diazenyl formation: the key for manganese-catalysed alcohol conversion into (E)-alkenes | Azofra Mesa, Luis Miguel ; Poater, Albert | Artículo |  |
| 15 | | 2019 | Hydrogen Evolution in [NiFe] Hydrogenases: A Case of Heterolytic Approach between Proton and Hydride | Qiu, Siyao; Azofra Mesa, Luis Miguel ; Macfarlane, Douglas R.; Sun, Chenghua | Artículo |  |
| 16 | | 2019 | MoS2 Polymorphic Engineering Enhances Selectivity in the Electrochemical Reduction of Nitrogen to Ammonia | Suryanto, Bryan H. R.; Wang, Dabin; Azofra Mesa, Luis Miguel ; Harb, Moussab; Cavallo, Luigi; Jalili, Rouhollah; Mitchell, David R. G.; Chatti, Manjunath; MacFarlane, Douglas R. | Artículo |  |
| 17 | | 2018 | DFT Modelling Tools in CO2 Conversion: Reaction Mechanism Screening and Analysis | Azofra Mesa, Luis Miguel ; Sun, Chenghua | Capítulo de libro | |
| 18 | | 2018 | Energy-Efficient Nitrogen Reduction to Ammonia at Low Overpotential in Aqueous Electrolyte under Ambient Conditions | Wang, Dabin; Azofra Mesa, Luis Miguel ; Harb, Moussab; Cavallo, Luigi; Zhang, Xinyi; Suryanto, Bryan H. R.; MacFarlane, Douglas R. | Artículo |  |
| 19 | | 2018 | Rational Electrode–Electrolyte Design for Efficient Ammonia Electrosynthesis under Ambient Conditions | Suryanto, Bryan H. R.; Kang, Colin S. M.; Wang, Dabin; Xiao, Changlong; Zhou, Fengling; Azofra Mesa, Luis Miguel ; Cavallo, Luigi; Zhang, Xinyi; MacFarlane, Douglas R. | Artículo |  |
| 20 | | 2018 | Highly Chemo- and Stereoselective Transfer Semihydrogenation of Alkynes Catalyzed by a Stable, Well-Defined Manganese(II) Complex | Brzozowska, Aleksandra; Azofra Mesa, Luis Miguel ; Zubar, Viktoriia; Atodiresei, Iuliana; Cavallo, Luigi; Rueping, Magnus; El-Sepelgy, Osama | Artículo |  |