Finite-size corrections of defect energy levels involving ionic polarization S Falletta, J Wiktor, A Pasquarello
Physical Review B 102 (4), 041115, 2020
36 2020 Conversational support for education DE Akcora, A Belli, M Berardi, S Casola, N Di Blas, S Falletta, A Faraotti, ...
Artificial Intelligence in Education: 19th International Conference, AIED …, 2018
27 2018 Range-separated hybrid functionals for accurate prediction of band gaps of extended systems J Yang, S Falletta, A Pasquarello
npj Computational Materials 9 (1), 108, 2023
18 2023 Small Electron Polarons in CsPbBr3 : Competition between Electron Localization and Delocalization N Osterbacka, P Erhart, S Falletta, A Pasquarello, J Wiktor
Chemistry of Materials 32 (19), 8393-8400, 2020
18 2020 One-shot approach for enforcing piecewise linearity on hybrid functionals: application to band gap predictions J Yang, S Falletta, A Pasquarello
The Journal of Physical Chemistry Letters 13 (13), 3066-3071, 2022
16 2022 Polarons free from many-body self-interaction in density functional theory S Falletta, A Pasquarello
Physical Review B 106 (12), 125119, 2022
15 2022 Many-body self-interaction and polarons S Falletta, A Pasquarello
Physical Review Letters 129 (12), 126401, 2022
13 2022 Unraveling the synergy between metal–organic frameworks and co-catalysts in photocatalytic water splitting S Falletta, P Gono, Z Guo, S Kampouri, KC Stylianou, A Pasquarello
Journal of Materials Chemistry A 8 (39), 20493-20502, 2020
9 2020 Chemical Trend of Nonradiative Recombination in B Dou, S Falletta, J Neugebauer, C Freysoldt, X Zhang, SH Wei
Physical Review Applied 19 (5), 054054, 2023
4 2023 Hubbard U through polaronic defect states S Falletta, A Pasquarello
npj Computational Materials 8 (1), 263, 2022
4 2022 An Innovative Nb3Sn Film Approach and its Potential for SRF Applications E Barzi, C Ciaccia, S Falletta, D Turrioni, A Kikuchi, H Hayano, T Saeki, ...
Thomas Jefferson National Accelerator Facility (TJNAF), Newport News, VA …, 2018
4 2018 Polaron hopping through piecewise-linear functionals S Falletta, A Pasquarello
Physical Review B 107 (20), 205125, 2023
3 2023 Nonempirical semilocal density functionals for correcting the self-interaction of polaronic states S Falletta, A Pasquarello
Journal of Applied Physics 135 (13), 2024
1 2024 Unified Differentiable Learning of the Electric Enthalpy and Dielectric Properties with Exact Physical Constraints S Falletta, A Cepellotti, CW Tan, A Johansson, A Musaelian, CJ Owen, ...
arXiv preprint arXiv:2403.17207, 2024
2024 Addressing the Band Gap Problem with a Machine-Learned Exchange Functional K Bystrom, S Falletta, B Kozinsky
arXiv preprint arXiv:2403.17002, 2024
2024 Machine Learning of Density Functionals for Accurate, Large-Scale Materials Simulations K Bystrom, S Falletta, B Kozinsky
Bulletin of the American Physical Society, 2024
2024 Learning polarization using equivariant neural networks S Falletta, A Cepellotti, A Musaelian, A Johansson, CW Tan, B Kozinsky
Bulletin of the American Physical Society, 2024
2024 Self-Interaction and Polarons in Density Functional Theory S Falletta
EPFL, 2023
2023 Charge corrections for electronic transitions at defects with ionic and electronic screening C Freysoldt, T Gake, Y Kumagai, F Oba, B Dou, S Falletta
Workshop" First-principles modeling of defects in solids: Charges meet lattices", 2022
2022 Polarons in semilocal density functional theory: localization, many-body self-interaction, and formation energy S Falletta, A Pasquarello
APS March Meeting Abstracts 2022, F48. 003, 2022
2022 
Alfredo PasquarelloProfessor of Condensed Matter Physics, EPFLПодтвержден адрес электронной почты в домене epfl.ch
