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Revealing Charge-Transfer Effects in Gas-Phase Water Chemistry 2012 Cappelletti, David Michele; Ronca, Enrico; Belpassi, Leonardo; Tarantelli, Francesco; Pirani, Fernando
Adsorption of organic dyes on TiO2 surfaces in dye-sensitized solar cells: interplay of theory and experiment 2012 Anselmi, Chiara; Mosconi, Edoardo; Pastore, Mariachiara; Ronca, Enrico; De Angelis, Filippo
Influence of the dye molecular structure on the TiO2 conduction band in dye-sensitized solar cells: disentangling charge transfer and electrostatic effects 2013 Ronca, Enrico; Pastore, M.; Belpassi, Leonardo; Tarantelli, Francesco; De Angelis, F.
High open-circuit voltages: Evidence for a sensitizer-induced tio 2 conduction band shift in ru(ii)-dye sensitized solar cells 2013 Moehl, Thomas; Tsao, Hoi Nok; Wu, Kuan-Lin; Hsu, Hui-Chu; Chi, Yun; Ronca, Enrico; De Angelis, Filippo; Nazeeruddin, Mohammad K.; Grätzel, Michael
Inherent Electronic Trap States in TiO2 Nanocrystals: Effect of Saturation and Sintering 2013 Nunzi, Francesca; Mosconi, E.; Storchi, L.; Ronca, Enrico; Selloni, A.; Grätzel, M.; De Angelis, F.
Modeling the effect of ionic additives on the optical and electronic properties of a dye-sensitized TiO2heterointerface: Absorption, charge injection and aggregation 2013 Agrawal, Saurabh; Leijtens, Tomas; Ronca, Enrico; Pastore, Mariachiara; Snaith, Henry; De Angelis, Filippo
Cation-induced band-gap tuning in organohalide perovskites: Interplay of spin-orbit coupling and octahedra tilting 2014 Amat, Anna; Mosconi, Edoardo; Ronca, Enrico; Quarti, Claudio; Umari, Paolo; Nazeeruddin, Md. K.; Grätzel, Michael; De Angelis, Filippo
Density Relaxation in Time-Dependent Density Functional Theory: Combining Relaxed Density Natural Orbitals and Multireference Perturbation Theories for an Improved Description of Excited States 2014 Ronca, Enrico; Angeli, Celestino; Belpassi, Leonardo; De Angelis, Filippo; Tarantelli, Francesco; Pastore, Mariachiara
Time-dependent density functional theory modeling of spin-orbit coupling in ruthenium and osmium solar cell sensitizers 2014 Ronca, Enrico; De Angelis, Filippo; Fantacci, Simona
First-principles investigation of the TiO2/organohalide perovskites interface: The role of interfacial chlorine 2014 Mosconi, Edoardo; Ronca, Enrico; De Angelis, Filippo
Effect of sensitizer structure and TiO2 protonation on charge generation in dye-sensitized solar cells 2014 Ronca, Enrico; Marotta, Gabriele; Pastore, Mariachiara; De Angelis, Filippo
Charge-displacement analysis for excited states 2014 Ronca, Enrico; Mariachiara, Pastore; Belpassi, Leonardo; DE ANGELIS, Filippo; Celestino, Angeli; Renzo, Cimiraglia; Tarantelli, Francesco
Impact of spin-orbit coupling on photocurrent generation in ruthenium dye-sensitized solar cells 2014 Fantacci, Simona; Ronca, Enrico; De Angelis, Filippo
A quantitative view of charge transfer in the hydrogen bond: the water dimer case 2014 Ronca, Enrico; Belpassi, Leonardo; Tarantelli, Francesco
Energy level alignment at titanium oxide-dye interfaces: Implications for electron injection and light harvesting 2015 Lasser, Laurent; Ronca, Enrico; Pastore, Mariachiara; De Angelis, Filippo; Cornil, Jérôme; Lazzaroni, Roberto; Beljonne, David
Photoinduced energy shift in quantum-dot-sensitized TiO<inf>2</inf>: A first-principles analysis 2015 Azpiroz, Jon M.; Ronca, Enrico; De Angelis, Filippo
Spectral functions of the uniform electron gas via coupled-cluster theory and comparison to the and related approximations 2016 Mcclain, James; Lischner, Johannes; Watson, Thomas; Matthews, Devin A.; Ronca, Enrico; Louie, Steven G.; Berkelbach, Timothy C.; Kin-Lic Chan, Garnet
Time-dependent N-electron valence perturbation theory with matrix product state reference wavefunctions for large active spaces and basis sets: Applications to the chromium dimer and all-trans polyenes 2017 Sokolov, Alexander Yu; Guo, Sheng; Ronca, Enrico; Chan, Garnet Kin-Lic
Time-Step Targeting Time-Dependent and Dynamical Density Matrix Renormalization Group Algorithms with ab Initio Hamiltonians 2017 Ronca, E.; Li, Z.; Jimenez-Hoyos, C. A.; Chan, G. K. -L.
Cavity quantum electrodynamical Chern insulator: Towards light-induced quantized anomalous Hall effect in graphene 2019 Wang, Xiao; Ronca, Enrico; Sentef, Michael A.
Mostrati risultati da 1 a 20 di 36
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