| (In-) Stability of Tin Halide Perovskites: Ab Initio Molecular Dynamics Simulations of Perovskite/Water Interfaces W Kaiser, D Ricciarelli, E Mosconi, AA Alothman, F Ambrosio, ... Proceedings of International Conference on Hybrid and Organic Photovoltaics …, 2022 | | 2022 |
| A 2D lead halide hybrid system with the lowest bandgap and exciton binding energy D Pariari, S Mehta, S Mandal, A Mahata, T Pramanik, S Kamilya, ... APS March Meeting Abstracts 2023, T41. 003, 2023 | | 2023 |
| A 2D Lead Halide Hybrid System with the Lowest Bandgap and Exciton Binding Energy A Hall, D Pariari, S Mehta, S Mandal, A Mahata, T Pramanik, S Kamilya, ... | | |
| A Cobalt Molecular Catalyst for Hydrogen Evolution Reaction with Remarkable Activity in Phosphate Buffered Water Solution C Trotta, P Dahiya, L Baldinelli, GM Rodriguez, P Chakraborty, G Bistoni, ... Catalysis Science & Technology, 2024 | 2 | 2024 |
| A Combined Computational and Experimental Study of Polynuclear Ru− TPPZ Complexes: Insight into the Electronic and Optical Properties of Coordination Polymers S Fantacci, F De Angelis, J Wang, S Bernhard, A Selloni Journal of the American Chemical Society 126 (31), 9715-9723, 2004 | 100 | 2004 |
| A combined electrochemical, spectroscopic and computational investigation on electronic properties of Zn (II)-diarylporphyrinates for DSC F Tessore, PR Mussini, A Orbelli Biroli, M Pizzotti, C Biaggi, G Di Carlo, ... Second International Meeting on Organic Materials for a Better Future …, 2012 | | 2012 |
| A combined experimental and theoretical approach revealing a direct mechanism for bifunctional water splitting on doped copper phosphide I Mondal, A Mahata, H Kim, U Pal, F De Angelis, JY Park Nanoscale 12 (34), 17769-17779, 2020 | 22 | 2020 |
| A combined molecular dynamics and computational spectroscopy study of a dye-sensitized solar cell R Gebauer, F De Angelis New Journal of Physics 13 (8), 085013, 2011 | 14 | 2011 |
| A computational approach to the electronic and optical properties of Ru (II) and Ir (III) polypyridyl complexes: Applications to DSC, OLED and NLO S Fantacci, F De Angelis Coordination Chemistry Reviews 255 (21-22), 2704-2726, 2011 | 196 | 2011 |
| A computational approach to the electronic, optical and acid–base properties of Ru (II) dyes for photoelectrochemical solar cells applications MG Lobello, F De Angelis, S Fantacci Polyhedron 82, 88-103, 2014 | 4 | 2014 |
| A computational investigation of organic dyes for dye-sensitized solar cells: benchmark, strategies, and open issues M Pastore, E Mosconi, F De Angelis, M Grätzel The Journal of Physical Chemistry C 114 (15), 7205-7212, 2010 | 396 | 2010 |
| A conversation with Henry Snaith F De Angelis, PV Kamat ACS Energy Letters 2 (11), 2552-2554, 2017 | 1 | 2017 |
| A conversation with Michael Grätzel F De Angelis, P Kamat ACS Energy Letters 2 (7), 1674-1676, 2017 | 8 | 2017 |
| A density functional study on the Pt (0)-catalysed hydrosilylation of ethylene G Giorgi, F De Angelis, N Re, A Sgamellotti Journal of Molecular Structure: THEOCHEM 623 (1-3), 277-288, 2003 | 25 | 2003 |
| A DFT investigation of base-catalyzed β-elimination reactions in water solution for systems activated by the pyridine ring: Theory vs. experiment E Mosconi, F De Angelis, F Tarantelli, S Alunni, A Sgamellotti Chemical Physics Letters 460 (1-3), 100-107, 2008 | 4 | 2008 |
| A DFT, TDDFT and EFISH investigation on the second order NLO response of push-pull porphinato complexes (M= Zn, Ni). The role of the metal. M Pizzotti, R Ugo, F Tessore, T Morotti, F De Angelis, S Fantacci, ... | | 2007 |
| A Dynamic Density Functional Study of the Stepwise Migratory Insertion of Isocyanides into Zirconium− Carbon Bonds Anchored to a Calix [4] arene Moiety S Fantacci, F De Angelis, A Sgamellotti, N Re Organometallics 21 (20), 4090-4098, 2002 | 11 | 2002 |
| A dynamical density functional study of acetylene to vinylidene isomerization in (Cp)(CO) 2Mn (HC= CH) RE N Re, S Antonio, F DE ANGELIS ORGANOMETALLICS 21, 2715-2723, 2002 | | 2002 |
| A dynamical density functional study of CO insertion into the metal–alkyl bond in Ti (Cp) 2 (CH 3) 2 F De Angelis, A Sgamellotti, N Re Journal of the Chemical Society, Dalton Transactions, 1023-1028, 2001 | 8 | 2001 |
| A dynamical density functional study of CO migration in the Reppe carbonylation F De Angelis, N Re, A Sgamellotti, A Selloni, J Weber, C Floriani Chemical physics letters 291 (1-2), 57-63, 1998 | 9 | 1998 |
