| First-principles study of Na insertion at TiO 2 anatase surfaces: new hints for Na-ion battery design A Massaro, AB Muñoz-García, P Maddalena, F Bella, G Meligrana, ... Nanoscale Advances 2 (7), 2745-2751, 2020 | 80 | 2020 |
| Tuning optical and electronic properties in novel carbazole photosensitizers for p-type dye-sensitized solar cells A Carella, R Centore, F Borbone, M Toscanesi, M Trifuoggi, F Bella, ... Electrochimica Acta 292, 805-816, 2018 | 69 | 2018 |
| Effect of Coordination Sphere Geometry of Copper Redox Mediators on Regeneration and Recombination Behavior in Dye-Sensitized Solar Cell Applications Y Saygili, M Stojanovic, H Michaels, J Tiepelt, J Teuscher, A Massaro, ... ACS Applied Energy Materials 1 (9), 4950-4962, 2018 | 53 | 2018 |
| Oxygen evolution reaction at the Mo/W-doped bismuth vanadate surface: Assessing the dopant role by DFT calculations A Massaro, A Pecoraro, S Hernández, G Talarico, AB Muñoz-García, ... Molecular Catalysis 517, 112036, 2022 | 33 | 2022 |
| Unveiling Oxygen Redox Activity in P2-Type NaxNi0.25Mn0.68O2 High-Energy Cathode for Na-Ion Batteries A Massaro, AB Munoz-Garcia, PP Prosini, C Gerbaldi, M Pavone ACS Energy Letters 6 (7), 2470-2480, 2021 | 30 | 2021 |
| First-Principles Study of Na Intercalation and Diffusion Mechanisms at 2D MoS2/Graphene Interfaces A Massaro, A Pecoraro, AB Muñoz-García, M Pavone The Journal of Physical Chemistry C 125 (4), 2276-2286, 2021 | 29 | 2021 |
| Monoclinic and Orthorhombic NaMnO2 for Secondary Batteries: A Comparative Study J Manzi, A Paolone, O Palumbo, D Corona, A Massaro, R Cavaliere, ... Energies 14 (5), 1230, 2021 | 19 | 2021 |
| Ab initio study of PbCr (1− x) S x O 4 solid solution: an inside look at Van Gogh Yellow degradation AB Munoz-Garcia, A Massaro, M Pavone Chemical Science 7 (7), 4197-4203, 2016 | 19 | 2016 |
| Sodium diffusion in ionic liquid-based electrolytes for Na-ion batteries: the effect of polarizable force fields A Massaro, J Avila, K Goloviznina, I Rivalta, C Gerbaldi, M Pavone, ... Physical Chemistry Chemical Physics 22 (35), 20114-20122, 2020 | 18 | 2020 |
| d-Glucose Adsorption on the TiO2 Anatase (100) Surface: A Direct Comparison Between Cluster-Based and Periodic Approaches V Butera, A Massaro, AB Muñoz-García, M Pavone, H Detz Frontiers in Chemistry 9, 716329, 2021 | 11 | 2021 |
| Na uptake at TiO2 anatase surfaces under electric field control: A first-principles study F Fasulo, A Massaro, AB Muñoz-García, M Pavone Journal of Materials Research 37 (19), 3216-3226, 2022 | 7 | 2022 |
| Ru-Doping of P2-NaxMn0.75Ni0.25O2-Layered Oxides for High-Energy Na-Ion Battery Cathodes: First-Principles Insights on Activation and Control of … A Massaro, A Langella, C Gerbaldi, GA Elia, AB Muñoz-García, M Pavone ACS Applied Energy Materials 5 (9), 10721-10730, 2022 | 7 | 2022 |
| First‐principles insights on anion redox activity in NaxFe1/8Ni1/8Mn3/4O2: Toward efficient high‐energy cathodes for Na‐ion batteries A Massaro, A Langella, AB Muñoz‐García, M Pavone Journal of the American Ceramic Society 106 (1), 109-119, 2023 | 6 | 2023 |
| New insights on singlet oxygen release from Li-air battery cathode: Periodic DFT versus CASPT2 embedded cluster calculations F Fasulo, A Massaro, AB Muñoz-García, M Pavone Journal of Chemical Theory and Computation 19 (15), 5210-5220, 2023 | 5 | 2023 |
| Vinylene carbonate reactivity at lithium metal surface: first-principles insights into the early steps of SEI formation F Fasulo, AB Muñoz-García, A Massaro, O Crescenzi, C Huang, ... Journal of Materials Chemistry A 11 (11), 5660-5669, 2023 | 5 | 2023 |
| Tuning perovskite–based oxides for effective electrodes in solid oxide electrochemical cells AB Muñoz-García, A Massaro, E Schiavo, M Pavone Solid Oxide-Based Electrochemical Devices, 1-25, 2020 | 5 | 2020 |
| Azobenzene-based optoelectronic transistors for neurohybrid building blocks F Corrado, U Bruno, M Prato, A Carella, V Criscuolo, A Massaro, ... Nature Communications 14 (1), 6760, 2023 | 4 | 2023 |
| Role of defect-driven surface reconstructions in transition metal oxide electrocatalysis towards OER/ORR: A quantum-mechanical perspective F Fasulo, A Massaro, A Pecoraro, AB Muñoz-García, M Pavone Current Opinion in Electrochemistry, 101412, 2023 | 2 | 2023 |
| Structural Evolution of Air-Exposed Layered Oxide Cathodes for Sodium-Ion Batteries: An Example of Ni-doped NaxMnO2 G Brugnetti, C Triolo, A Massaro, I Ostroman, N Pianta, C Ferrara, ... Chemistry of Materials 35 (20), 8440-8454, 2023 | 2 | 2023 |
| First-principles design of nanostructured electrode materials for Na-ion batteries: challenges and perspectives A Massaro, F Fasulo, A Pecoraro, A Langella, AB Munoz-Garcia, ... Physical Chemistry Chemical Physics, 2023 | 2 | 2023 |
Ana Belén Muñoz-GarcíaAssociate Professor, Department of Physics, University of Naples Federico IIVerifierad e-postadress på unina.it
