Varrassi, L.; Ellinger, F.; Flage-Larsen, E.; Wolloch, M.; Kresse, G.; Marzari, N.; Franchini, C., Automated workflow for accurate high-throughput GW calculations using plane waves, «NPJ COMPUTATIONAL MATERIALS», 2025, 11, Article number: 351 , pp. 1 - 14 [Scientific article]
Joseph, D; Franchini, C, Coupling between small polarons and ferroelectricity in BaTiO3, «PHYSICAL REVIEW MATERIALS», 2025, 9, pp. 1 - 10 [Scientific article]
Si, L.; Liu, P.; Franchini, C., Evolution of the Coulomb interactions in correlated transition-metal perovskite oxides from the constrained random phase approximation, «PHYSICAL REVIEW MATERIALS», 2025, 9, Article number: 015001 , pp. 1 - 21 [Scientific article]Open Access
Baumsteiger, J.; Celiberti, L.; Rinke, P.; Todorovic, M.; Franchini, C., Exploring noncollinear magnetic energy landscapes with Bayesian optimization, «DIGITAL DISCOVERY», 2025, 4, pp. 1639 - 1650 [Scientific article]
Houtput, M.; Ranalli, L.; Verdi, C.; Klimin, S.; Ragni, S.; Franchini, C.; Tempere, J., First-principles theory of nonlinear long-range electron-phonon interaction, «PHYSICAL REVIEW. B», 2025, 111, Article number: 184320 , pp. 1 - 33 [Scientific article]
Pourovskii, L. V.; Fiore Mosca, D.; Celiberti, L.; Khmelevskyi, S.; Paramekanti, A.; Franchini, C., Hidden orders in spin–orbit-entangled correlated insulators, «NATURE REVIEWS. MATERIALS», 2025, 10, pp. 674 - 696 [Scientific article]
Angeletti, A.; Leoni, L.; Massa, D.; Pasquini, L.; Papanikolaou, S.; Franchini, C., Hydrogen diffusion in magnesium using machine learning potentials: a comparative study, «NPJ COMPUTATIONAL MATERIALS», 2025, 11, Article number: 85 , pp. 1 - 8 [Scientific article]Open Access
Birschitzky, V. C.; Leoni, L.; Reticcioli, M.; Franchini, C., Machine Learning Small Polaron Dynamics, «PHYSICAL REVIEW LETTERS», 2025, 134, Article number: 216301 , pp. 1 - 8 [Scientific article]
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, Multi-technique characterization of rhodium gem-dicarbonyls on TiO2(110), «CHEMICAL SCIENCE», 2025, 16, pp. 1 - 9 [Scientific article]
Ragni, S.; Miskic, T.; Hahn, T.; Prokof'Ev, N.; Barisic, O. S.; Nagaosa, N.; Franchini, C.; Mishchenko, A. S., Polarons with arbitrary nonlinear electron-phonon interaction, «PHYSICAL REVIEW RESEARCH», 2025, 7, Article number: 043304 , pp. 1 - 16 [Scientific article]
Cao, Y.; Wang, J.; Liu, M.; Liu, Y.; Ma, H.; Franchini, C.; Sun, Y.; Kresse, G.; Chen, X. -Q.; Liu, P., Quantum Delocalization Enables Water Dissociation on Ru(0001), «PHYSICAL REVIEW LETTERS», 2025, 134, Article number: 178001 , pp. 1 - 8 [Scientific article]
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, Spin Matters: A Multidisciplinary Roadmap to Understanding Spin Effects in Oxygen Evolution Reaction During Water Electrolysis, «ADVANCED ENERGY MATERIALS», 2025, 16, Article number: e70485 , pp. 1 - 65 [Scientific article]
Romano, S; De Hijes, Pm; Meier, M; Kresse, G; Franchini, C; Dellago, C, Structure and Dynamics of the Magnetite(001)/Water Interface from Molecular Dynamics Simulations Based on a Neural Network Potential, «JOURNAL OF CHEMICAL THEORY AND COMPUTATION», 2025, 21, pp. 1951 - 1960 [Scientific article]Open Access
Sombut, Panukorn; Meier, Matthias; Eder, Moritz; Angerler, Thomas; Gamba, Oscar; Schmid, Michael; Diebold, Ulrike; Franchini, Cesare; Parkinson, Gareth S., The surface phase diagram of Fe3O4(001) revisited, «RSC APPLIED INTERFACES», 2025, 2, pp. 1 - 11 [Scientific article]
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., A Multitechnique Study of C2H4 Adsorption on a Model Single-Atom Rh1 Catalyst, «JOURNAL OF PHYSICAL CHEMISTRY. C», 2024, 128, pp. 15404 - 15411 [Scientific article]Open Access
