| The OpenMolcas Web: A Community-Driven Approach to Advancing Computational Chemistry G Li Manni, I Fdez. Galván, A Alavi, F Aleotti, F Aquilante, J Autschbach, ... Journal of Chemical Theory and Computation 19 (20), 6933-6991, 2023 | 56 | 2023 |
| Multidimensional potential energy surfaces resolved at the RASPT2 level for accurate photoinduced isomerization dynamics of azobenzene F Aleotti, L Soprani, A Nenov, R Berardi, A Arcioni, C Zannoni, M Garavelli Journal of chemical theory and computation 15 (12), 6813-6823, 2019 | 46 | 2019 |
| Imaging conical intersection dynamics during azobenzene photoisomerization by ultrafast X-ray diffraction D Keefer, F Aleotti, JR Rouxel, F Segatta, B Gu, A Nenov, M Garavelli, ... Proceedings of the National Academy of Sciences 118 (3), e2022037118, 2021 | 42 | 2021 |
| Spectral tuning and photoisomerization efficiency in push–pull azobenzenes: designing principles F Aleotti, A Nenov, L Salvigni, M Bonfanti, MM El-Tahawy, A Giunchi, ... The Journal of Physical Chemistry A 124 (46), 9513-9523, 2020 | 33 | 2020 |
| Parameterization of a linear vibronic coupling model with multiconfigurational electronic structure methods to study the quantum dynamics of photoexcited pyrene F Aleotti, D Aranda, M Yaghoubi Jouybari, M Garavelli, A Nenov, ... The Journal of Chemical Physics 154 (10), 2021 | 22 | 2021 |
| Conical intersection passages of molecules probed by x-ray diffraction and stimulated Raman spectroscopy Y Nam, D Keefer, A Nenov, I Conti, F Aleotti, F Segatta, JY Lee, ... The Journal of Physical Chemistry Letters 12 (51), 12300-12309, 2021 | 20 | 2021 |
| Unveiling the spatial distribution of molecular coherences at conical intersections by covariance X-ray diffraction signals SM Cavaletto, D Keefer, JR Rouxel, F Aleotti, F Segatta, M Garavelli, ... Proceedings of the National Academy of Sciences 118 (22), e2105046118, 2021 | 18 | 2021 |
| Diffractive imaging of conical intersections amplified by resonant infrared fields D Keefer, JR Rouxel, F Aleotti, F Segatta, M Garavelli, S Mukamel Journal of the American Chemical Society 143 (34), 13806-13815, 2021 | 12 | 2021 |
| Nonlinear molecular electronic spectroscopy via mctdh quantum dynamics: From exact to approximate expressions F Segatta, DA Ruiz, F Aleotti, M Yaghoubi, S Mukamel, M Garavelli, ... Journal of chemical theory and computation 19 (7), 2075-2091, 2023 | 8 | 2023 |
| Photoisomerization transition state manipulation by entangled two-photon absorption B Gu, D Keefer, F Aleotti, A Nenov, M Garavelli, S Mukamel Proceedings of the National Academy of Sciences 118 (47), e2116868118, 2021 | 8 | 2021 |
| Filatov (Gulak) A Alavi, F Aleotti, F Aquilante, J Autschbach, D Avagliano, A Baiardi, ... M, 0 | 7 | |
| Coupled electronic and nuclear motions during azobenzene photoisomerization monitored by ultrafast electron diffraction JR Rouxel, D Keefer, F Aleotti, A Nenov, M Garavelli, S Mukamel Journal of Chemical Theory and Computation 18 (2), 605-613, 2022 | 6 | 2022 |
| A Pyridyl-1, 2-azaborine Ligand for Phosphorescent Neutral Iridium (III) Complexes A Baschieri, F Aleotti, E Matteucci, L Sambri, M Mancinelli, A Mazzanti, ... Inorganic Chemistry 62 (5), 2456-2469, 2023 | 5 | 2023 |
| Engineering Azobenzene Derivatives to Control the Photoisomerization Process F Aleotti, V Petropoulos, H Van Overeem, M Pettini, M Mancinelli, ... The Journal of Physical Chemistry A 127 (49), 10435-10449, 2023 | 1 | 2023 |
| Ultrafast photochemistry and electron-diffraction spectra in n->(3s) Rydberg excited cyclobutanone resolved at the multireference perturbative level VK Jaiswal, F Montorsi, F Aleotti, F Segatta, D Keefer, S Mukamel, ... arXiv preprint arXiv:2402.09873, 2024 | | 2024 |
| Time-Resolved X-ray Absorption Spectroscopy: An MCTDH Quantum Dynamics Protocol F Segatta, D Aranda, F Aleotti, F Montorsi, S Mukamel, M Garavelli, ... Journal of Chemical Theory and Computation 20 (1), 307-322, 2023 | | 2023 |
| Simulation of photoinduced processes in organic chromophores: mapping photochemically relevant states for accurate dynamics F Aleotti alma, 2022 | | 2022 |
| Monitoring Ultrafast Photoisomerization of Azobenzene by Time-Resolved X-Ray Diffraction D Keefer, F Aleotti, J Rouxel, F Segatta, B Gu, A Nenov, M Garavelli, ... Laser Science, LW4F. 4, 2020 | | 2020 |
