First-principles predictions of Hall and drift mobilities in semiconductors S Poncé, F Macheda, ER Margine, N Marzari, N Bonini, F Giustino
Physical Review Research 3 (4), 043022, 2021
97 2021 Electron–phonon physics from first principles using the EPW code H Lee, S Poncé, K Bushick, S Hajinazar, J Lafuente-Bartolome, ...
npj Computational Materials 9 (1), 156, 2023
80 2023 Magnetotransport phenomena in -doped diamond from first principles F Macheda, N Bonini
Physical Review B 98 (20), 201201, 2018
46 2018 Electron-phonon interaction and longitudinal-transverse phonon splitting in doped semiconductors F Macheda, P Barone, F Mauri
Physical review letters 129 (18), 185902, 2022
32 2022 Electron-phonon interaction and phonon frequencies in two-dimensional doped semiconductors F Macheda, T Sohier, P Barone, F Mauri
Physical Review B 107 (9), 094308, 2023
21 2023 Theory and computation of Hall scattering factor in graphene F Macheda, S Poncé, F Giustino, N Bonini
Nano Letters 20 (12), 8861-8865, 2020
21 2020 First-principles study of electronic transport and structural properties of in its high-temperature phase C Di Paola, F Macheda, S Laricchia, C Weber, N Bonini
Physical Review Research 2 (3), 033055, 2020
20 2020 EPIq: an open-source software for the calculation of electron-phonon interaction related properties G Marini, G Marchese, G Profeta, J Sjakste, F Macheda, N Vast, F Mauri, ...
Computer Physics Communications 295, 108950, 2024
17 2024 Born effective charges and vibrational spectra in superconducting and bad conducting metals G Marchese, F Macheda, L Binci, M Calandra, P Barone, F Mauri
Nature Physics 20 (1), 88-94, 2024
16 2024 Probing enhanced electron-phonon coupling in graphene by infrared resonance Raman spectroscopy T Venanzi, L Graziotto, F Macheda, S Sotgiu, T Ouaj, E Stellino, ...
Physical review letters 130 (25), 256901, 2023
14 2023 Theory of infrared double-resonance Raman spectrum in graphene: The role of the zone-boundary electron-phonon enhancement L Graziotto, F Macheda, T Sohier, M Calandra, F Mauri
Physical Review B 109 (7), 075420, 2024
9 2024 High-temperature superconductivity in the lanthanide hydrides at extreme pressures Y Wei, F Macheda, Z Zhao, T Tse, E Plekhanov, N Bonini, C Weber
Applied Sciences 12 (2), 874, 2022
8 2022 Infrared resonance Raman of bilayer graphene: Signatures of massive fermions and band structure on the 2D peak L Graziotto, F Macheda, T Venanzi, G Marchese, S Sotgiu, T Ouaj, ...
Nano letters 24 (6), 1867-1873, 2024
7 2024 Raman scattering with infrared excitation resonant with the indirect band gap S Sotgiu, T Venanzi, F Macheda, E Stellino, M Ortolani, P Postorino, ...
Physical Review B 106 (8), 085204, 2022
6 2022 Computational materials discovery for lanthanide hydrides at high pressure for high temperature superconductivity E Plekhanov, Z Zhao, F Macheda, Y Wei, N Bonini, C Weber
Physical Review Research 4 (1), 013248, 2022
6 * 2022 First-principles calculations of dynamical Born effective charges, quadrupoles, and higher order terms from the charge response in large semiconducting and metallic systems F Macheda, P Barone, F Mauri
Physical Review B 110 (9), 094306, 2024
4 2024 Ab initio Van der Waals electrodynamics: Polaritons and electron scattering from plasmons and phonons in BN-capped grapheneF Macheda, F Mauri, T Sohier
Physical Review B 110 (11), 115407, 2024
3 2024 Ab initio prediction of thermomagnetic and thermoelectric transport phenomena in 3d and 2d materials F Macheda
King's College London, 2021
3 2021 High-and low-energy many-body effects of graphene in a unified approach A Guandalini, G Caldarelli, F Macheda, F Mauri
Physical Review B 111 (7), 075118, 2025
2 2025 Spinodal-assisted nucleation in the two-dimensional state Potts model with short-to-long-range interactions G Gagliardi, F Macheda
Physical Review E 104 (1), 014115, 2021
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