FRANCHINI, CESARE
FRANCHINI, CESARE
DIFA - DIPARTIMENTO DI FISICA E ASTRONOMIA "AUGUSTO RIGHI"
Docenti di ruolo di Ia fascia
Automated workflow for accurate high-throughput GW calculations using plane waves
2025 Varrassi, L.; Ellinger, F.; Flage-Larsen, E.; Wolloch, M.; Kresse, G.; Marzari, N.; Franchini, C.
Coupling between small polarons and ferroelectricity in BaTiO3
2025 Joseph, D; Franchini, C
Evolution of the Coulomb interactions in correlated transition-metal perovskite oxides from the constrained random phase approximation
2025 Si, L.; Liu, P.; Franchini, C.
Exploring noncollinear magnetic energy landscapes with Bayesian optimization
2025 Baumsteiger, J.; Celiberti, L.; Rinke, P.; Todorovic, M.; Franchini, C.
First-principles theory of nonlinear long-range electron-phonon interaction
2025 Houtput, M.; Ranalli, L.; Verdi, C.; Klimin, S.; Ragni, S.; Franchini, C.; Tempere, J.
Hidden orders in spin–orbit-entangled correlated insulators
2025 Pourovskii, L. V.; Fiore Mosca, D.; Celiberti, L.; Khmelevskyi, S.; Paramekanti, A.; Franchini, C.
Hydrogen diffusion in magnesium using machine learning potentials: a comparative study
2025 Angeletti, A.; Leoni, L.; Massa, D.; Pasquini, L.; Papanikolaou, S.; Franchini, C.
Machine Learning Small Polaron Dynamics
2025 Birschitzky, V. C.; Leoni, L.; Reticcioli, M.; Franchini, C.
Multi-technique characterization of rhodium gem-dicarbonyls on TiO2(110)
2025 Eder, M; Lewis, Fj; Hütner, Ji; Sombut, P; Hao, Ms; Rath, D; Ryan, P; Balajka, J; Wagner, M; Meier, M; Franchini, C; Pacchioni, G; Diebold, U; Schmid, M; Libisch, F; Pavelec, J; Parkinson, Gs
Polarons with arbitrary nonlinear electron-phonon interaction
2025 Ragni, S.; Miskic, T.; Hahn, T.; Prokof'Ev, N.; Barisic, O. S.; Nagaosa, N.; Franchini, C.; Mishchenko, A. S.
Quantum Delocalization Enables Water Dissociation on Ru(0001)
2025 Cao, Y.; Wang, J.; Liu, M.; Liu, Y.; Ma, H.; Franchini, C.; Sun, Y.; Kresse, G.; Chen, X. -Q.; Liu, P.
Spin Matters: A Multidisciplinary Roadmap to Understanding Spin Effects in Oxygen Evolution Reaction During Water Electrolysis
2025 Van Der Minne, E; Vensaus, P; Ratovskii, V; Hariharan, S; Behrends, J; Franchini, C; Fransson, J; Dhesi, Ss; Gunkel, F; Gossing, F; Katsoukis, G; Kramm, Ui; Lingenfelder, M; Lan, Qq; Kolen'Ko, Yv; Li, Y; Mohan, Rr; Mccord, J; Ni, Lm; Pavarini, E; Pentcheva, R; Waldeck, Dh; Verhage, M; Yu, Ak; Xu, Zj; Torelli, P; Mauri, S; Avarvari, N; Bieberle-Hütter, A; Baeumer, C
Structure and Dynamics of the Magnetite(001)/Water Interface from Molecular Dynamics Simulations Based on a Neural Network Potential
2025 Romano, S; De Hijes, Pm; Meier, M; Kresse, G; Franchini, C; Dellago, C
The surface phase diagram of Fe3O4(001) revisited
2025 Sombut, Panukorn; Meier, Matthias; Eder, Moritz; Angerler, Thomas; Gamba, Oscar; Schmid, Michael; Diebold, Ulrike; Franchini, Cesare; Parkinson, Gareth S.
A Multitechnique Study of C2H4 Adsorption on a Model Single-Atom Rh1 Catalyst
2024 Wang, C.; Sombut, P.; Puntscher, L.; Ulreich, M.; Pavelec, J.; Rath, D.; Balajka, J.; Meier, M.; Schmid, M.; Diebold, U.; Franchini, C.; Parkinson, G. S.
Analytic method for quadratic polarons in nonparabolic bands
2024 Klimin S.N.; Tempere J.; Houtput M.; Ragni S.; Hahn T.; Franchini C.; Mishchenko A.S.
Atomic-Scale View at the Segregation of Alkali Metals toward the KTaO3(001) Perovskite Surface
2024 Alexander, A.; Reticcioli, M.; Albons, L.; Redondo, J.; Corrias, M.; Pis, I.; Wang, Z.; Johanek, V.; Myslivecek, J.; Franchini, C.; Wrana, D.; Setvin, M.
CO‐induced dimer decay responsible for gem‐dicarbonyl formation on a model single‐atom catalyst
2024 Wang, Chunlei; Sombut, Panukorn; Puntscher, Lena; Jakub, Zdenek; Meier, Matthias; Pavelec, Jiri; Bliem, Roland; Schmid, Michael; Diebold, Ulrike; Franchini, Cesare; Parkinson, Gareth Steven
Digging Its Own Site: Linear Coordination Stabilizes a Pt1/Fe2O3 Single-Atom Catalyst
2024 Rafsanjani-Abbasi, A.; Buchner, F.; Lewis, F. J.; Puntscher, L.; Kraushofer, F.; Sombut, P.; Eder, M.; Pavelec, J.; Rheinfrank, E.; Franceschi, G.; Birschitzky, V.; Riva, M.; Franchini, C.; Schmid, M.; Diebold, U.; Meier, M.; Madsen, G. K. H.; Parkinson, G. S.
Electron mobilities in SrTiO3 and KTaO3: Role of phonon anharmonicity, mass renormalization, and disorder
2024 Ranalli, L.; Verdi, C.; Zacharias, M.; Even, J.; Giustino, F.; Franchini, C.
| Titolo | Autore(i) | Anno | Periodico | Editore | Tipo | File |
|---|---|---|---|---|---|---|
| Automated workflow for accurate high-throughput GW calculations using plane waves | Varrassi, L.; Ellinger, F.; Flage-Larsen, E.; Wolloch, M.; Kresse, G.; Marzari, N.; Franchini, C. | 2025-01-01 | NPJ COMPUTATIONAL MATERIALS | - | 1.01 Articolo in rivista | unpaywall-bitstream-26009681.pdf |
| Coupling between small polarons and ferroelectricity in BaTiO3 | Joseph, D; Franchini, C | 2025-01-01 | PHYSICAL REVIEW MATERIALS | - | 1.01 Articolo in rivista | 5z43-rm34.pdf; 2503.12693v4.pdf |
| Evolution of the Coulomb interactions in correlated transition-metal perovskite oxides from the constrained random phase approximation | Si, L.; Liu, P.; Franchini, C. | 2025-01-01 | PHYSICAL REVIEW MATERIALS | - | 1.01 Articolo in rivista | PhysRevMaterials.9.015001.pdf |
| Exploring noncollinear magnetic energy landscapes with Bayesian optimization | Baumsteiger, J.; Celiberti, L.; Rinke, P.; Todorovic, M.; Franchini, C. | 2025-01-01 | DIGITAL DISCOVERY | - | 1.01 Articolo in rivista | d4dd00402g.pdf |
| First-principles theory of nonlinear long-range electron-phonon interaction | Houtput, M.; Ranalli, L.; Verdi, C.; Klimin, S.; Ragni, S.; Franchini, C.; Tempere, J. | 2025-01-01 | PHYSICAL REVIEW. B | - | 1.01 Articolo in rivista | PhysRevB.111.184320.pdf |
| Hidden orders in spin–orbit-entangled correlated insulators | Pourovskii, L. V.; Fiore Mosca, D.; Celiberti, L.; Khmelevskyi, S.; Paramekanti, A.; Franchini, C. | 2025-01-01 | NATURE REVIEWS. MATERIALS | - | 1.01 Articolo in rivista | 2509.01788v1.pdf |
| Hydrogen diffusion in magnesium using machine learning potentials: a comparative study | Angeletti, A.; Leoni, L.; Massa, D.; Pasquini, L.; Papanikolaou, S.; Franchini, C. | 2025-01-01 | NPJ COMPUTATIONAL MATERIALS | - | 1.01 Articolo in rivista | Angeletti_npjCompMat_2025.pdf; 41524_2025_1555_MOESM1_ESM.pdf |
| Machine Learning Small Polaron Dynamics | Birschitzky, V. C.; Leoni, L.; Reticcioli, M.; Franchini, C. | 2025-01-01 | PHYSICAL REVIEW LETTERS | - | 1.01 Articolo in rivista | PhysRevLett.134.216301.pdf; SM (5).pdf |
| Multi-technique characterization of rhodium gem-dicarbonyls on TiO2(110) | Eder, M; Lewis, Fj; Hütner, Ji; Sombut, P; Hao, Ms; Rath, D; Ryan, P; Balajka, J; Wagner, M; Meie...r, M; Franchini, C; Pacchioni, G; Diebold, U; Schmid, M; Libisch, F; Pavelec, J; Parkinson, Gs | 2025-01-01 | CHEMICAL SCIENCE | - | 1.01 Articolo in rivista | document.pdf |
| Polarons with arbitrary nonlinear electron-phonon interaction | Ragni, S.; Miskic, T.; Hahn, T.; Prokof'Ev, N.; Barisic, O. S.; Nagaosa, N.; Franchini, C.; Mishc...henko, A. S. | 2025-01-01 | PHYSICAL REVIEW RESEARCH | - | 1.01 Articolo in rivista | 6127-phps.pdf |
| Quantum Delocalization Enables Water Dissociation on Ru(0001) | Cao, Y.; Wang, J.; Liu, M.; Liu, Y.; Ma, H.; Franchini, C.; Sun, Y.; Kresse, G.; Chen, X. -Q.; Li...u, P. | 2025-01-01 | PHYSICAL REVIEW LETTERS | - | 1.01 Articolo in rivista | 2412.00484v3.pdf |
| Spin Matters: A Multidisciplinary Roadmap to Understanding Spin Effects in Oxygen Evolution Reaction During Water Electrolysis | Van Der Minne, E; Vensaus, P; Ratovskii, V; Hariharan, S; Behrends, J; Franchini, C; Fransson, J;... Dhesi, Ss; Gunkel, F; Gossing, F; Katsoukis, G; Kramm, Ui; Lingenfelder, M; Lan, Qq; Kolen'Ko, Yv; Li, Y; Mohan, Rr; Mccord, J; Ni, Lm; Pavarini, E; Pentcheva, R; Waldeck, Dh; Verhage, M; Yu, Ak; Xu, Zj; Torelli, P; Mauri, S; Avarvari, N; Bieberle-Hütter, A; Baeumer, C | 2025-01-01 | ADVANCED ENERGY MATERIALS | - | 1.01 Articolo in rivista | Advanced Energy Materials - 2025 - van der Minne - Spin Matters A Multidisciplinary Roadmap to Understanding Spin Effects.pdf |
| Structure and Dynamics of the Magnetite(001)/Water Interface from Molecular Dynamics Simulations Based on a Neural Network Potential | Romano, S; De Hijes, Pm; Meier, M; Kresse, G; Franchini, C; Dellago, C | 2025-01-01 | JOURNAL OF CHEMICAL THEORY AND COMPUTATION | - | 1.01 Articolo in rivista | romano-et-al-2025-structure-and-dynamics-of-the-magnetite(001)-water-interface-from-molecular-dynamics-simulations.pdf |
| The surface phase diagram of Fe3O4(001) revisited | Sombut, Panukorn; Meier, Matthias; Eder, Moritz; Angerler, Thomas; Gamba, Oscar; Schmid, Michael;... Diebold, Ulrike; Franchini, Cesare; Parkinson, Gareth S. | 2025-01-01 | RSC APPLIED INTERFACES | - | 1.01 Articolo in rivista | d5lf00022j.pdf |
| A Multitechnique Study of C2H4 Adsorption on a Model Single-Atom Rh1 Catalyst | Wang, C.; Sombut, P.; Puntscher, L.; Ulreich, M.; Pavelec, J.; Rath, D.; Balajka, J.; Meier, M.; ...Schmid, M.; Diebold, U.; Franchini, C.; Parkinson, G. S. | 2024-01-01 | JOURNAL OF PHYSICAL CHEMISTRY. C | - | 1.01 Articolo in rivista | wang-et-al-2024-a-multitechnique-study-of-c2h4-adsorption-on-a-model-single-atom-rh1-catalyst.pdf; jp4c03588_si_001.pdf; Supplementary.zip |
| Analytic method for quadratic polarons in nonparabolic bands | Klimin S.N.; Tempere J.; Houtput M.; Ragni S.; Hahn T.; Franchini C.; Mishchenko A.S. | 2024-01-01 | PHYSICAL REVIEW. B | - | 1.01 Articolo in rivista | PhysRevB.110.075107.pdf |
| Atomic-Scale View at the Segregation of Alkali Metals toward the KTaO3(001) Perovskite Surface | Alexander, A.; Reticcioli, M.; Albons, L.; Redondo, J.; Corrias, M.; Pis, I.; Wang, Z.; Johanek, ...V.; Myslivecek, J.; Franchini, C.; Wrana, D.; Setvin, M. | 2024-01-01 | ACS APPLIED MATERIALS & INTERFACES | - | 1.01 Articolo in rivista | alexander-et-al-2024-atomic-scale-view-at-the-segregation-of-alkali-metals-toward-the-ktao3(001)-perovskite-surface.pdf; am4c13795_si_001.pdf |
| CO‐induced dimer decay responsible for gem‐dicarbonyl formation on a model single‐atom catalyst | Wang, Chunlei; Sombut, Panukorn; Puntscher, Lena; Jakub, Zdenek; Meier, Matthias; Pavelec, Jiri; ...Bliem, Roland; Schmid, Michael; Diebold, Ulrike; Franchini, Cesare; Parkinson, Gareth Steven | 2024-01-01 | ANGEWANDTE CHEMIE. INTERNATIONAL EDITION | - | 1.01 Articolo in rivista | Angew Chem Int Ed - 2024 - Wang - CO‐Induced Dimer Decay Responsible for Gem‐Dicarbonyl Formation on a Model Single‐Atom.pdf |
| Digging Its Own Site: Linear Coordination Stabilizes a Pt1/Fe2O3 Single-Atom Catalyst | Rafsanjani-Abbasi, A.; Buchner, F.; Lewis, F. J.; Puntscher, L.; Kraushofer, F.; Sombut, P.; Eder..., M.; Pavelec, J.; Rheinfrank, E.; Franceschi, G.; Birschitzky, V.; Riva, M.; Franchini, C.; Schmid, M.; Diebold, U.; Meier, M.; Madsen, G. K. H.; Parkinson, G. S. | 2024-01-01 | ACS NANO | - | 1.01 Articolo in rivista | rafsanjani-abbasi-et-al-2024-digging-its-own-site-linear-coordination-stabilizes-a-pt1-fe2o3-single-atom-catalyst.pdf; supplementary.zip; nn4c08781_si_002.pdf |
| Electron mobilities in SrTiO3 and KTaO3: Role of phonon anharmonicity, mass renormalization, and disorder | Ranalli, L.; Verdi, C.; Zacharias, M.; Even, J.; Giustino, F.; Franchini, C. | 2024-01-01 | PHYSICAL REVIEW MATERIALS | - | 1.01 Articolo in rivista | PhysRevMaterials.8.104603.pdf; Supplemental_Materials.pdf |