Sfoglia per Autore
Unraveling molecular trends in the oxidative H abstraction on the positive electrode of Li-ion batteries
2025 Ceribelli, N; Shao-Horn, Y; Giordano, L
Molecular-Level insights into Li-ion solvation in PVDF-based quasi-solid electrolytes: A First-Principles Study
2025 Ceribelli, N; Di Liberto, G; Giordano, L
Elucidating the Li-ion solvation structure in PVDF-based quasi-solid electrolytes
2025 Ceribelli, N; Di Liberto, G; Giordano, L
Lithium-Ion Solvation Shell in Polyvinylidene Difluoride-Based Quasi-Solid Electrolytes from Ab Initio Molecular Dynamics Simulations
2025 Ceribelli, N; Ceribelli, N; Di Liberto, G; Di Liberto, G; Giordano, L; Giordano, L
Li-ion solvation shell in PVDF-Based Quasi-Solid Electrolytes: A Molecular Perspective
2025 Ceribelli, N; Di Liberto, G; Giordano, L
Host–Guest Interactions and Transport Mechanism in Poly(vinylidene fluoride)-Based Quasi-Solid Electrolytes for Lithium Metal Batteries
2024 Vallana, N; Carena, E; Ceribelli, N; Mezzomo, L; Di Liberto, G; Mauri, M; Ferrara, C; Lorenzi, R; Giordano, L; Ruffo, R; Mustarelli, P
Role of Key Intermediates of Oxygen Evolution on MO (M = Ti, Ru, Ir): a Computational Electrochemistry Study
2024 Inico, E; Di Liberto, G; Giordano, L
Role of Key Intermediates of Oxygen Evolution on MO (M = Ti, Ru, Ir): a Computational Electrochemistry Study
2024 Inico, E; Di Liberto, G; Giordano, L
Regulating Oxygen Activity of Perovskites to Promote Activity and Selectivity for Methanol Oxidation to Formaldehyde
2024 Akkiraju, K; Rao, R; Hwang, J; Giordano, L; Wang, X; Crumlin, E; Weinberger, D; Shao-Horn, Y
Elucidating the Li-ion solvation structure in quasi-solid electrolytes by first principles calculations
2024 Ceribelli, N; DI LIBERTO, G; Giordano, L
Role of Li Electrode Redox Potential and Solid Electrolyte Interphase (SEI) Species on the Coulombic Efficiency of LiFSI-DME and LiFSI-FEC Electrolytes
2024 Wang, D; Orlando Plaza Rivera, C; Iriawan, H; Ceribelli, N; Giordano, L; Shao-Horn, Y
Role of solvation model on the stability of oxygenates on Pt(111): A comparison between microsolvation, extended bilayer, and extended metal/water interface
2024 Di Liberto, G; Giordano, L
Predicting the Stability of Single-Atom Catalysts in Electrochemical Reactions
2024 Di Liberto, G; Giordano, L; Pacchioni, G
Stability and Solvation of Key Intermediates of Oxygen Evolution on TiO2, RuO2, IrO2 (110) Surfaces: A Comparative DFT Study
2024 Inico, E; Di Liberto, G; Giordano, L
A Design Strategy for Highly Active Oxide Electrocatalysts by Incorporation of Oxygen-Vacancies
2024 Acharya, N; Karki, S; Giordano, L; Ramezanipour, F
PVDF-HFP Based, Quasi-Solid Nanocomposite Electrolytes for Lithium Metal Batteries
2024 Carena, E; Mezzomo, L; Vallana, N; Ceribelli, N; Di Liberto, G; Mostoni, S; Ferrara, C; Mauri, M; Lorenzi, R; Giordano, L; Ruffo, R; Mustarelli, P
Investigation of the key role of DMF solvent in PVDF-based electrolytes
2023 Ceribelli, N; Di Liberto, G; Giordano, L
Influence of Sr-Site Deficiency, Ca/Ba/La Doping on the Exsolution of Ni from SrTiO3
2023 O'Leary, W; Giordano, L; Park, J; Nonnenmann, S; Shao-Horn, Y; Rupp, J
Design principles for transition metal nitride stability and ammonia generation in acid
2023 Peng, J; Giner-Sanz, J; Giordano, L; Mounfield, W; Leverick, G; Yu, Y; Román-Leshkov, Y; Shao-Horn, Y
Single-atom electrocatalysis from first principles: Current status and open challenges
2023 Di Liberto, G; Barlocco, I; Giordano, L; Tosoni, S; Pacchioni, G
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