Polarons in materials C Franchini, M Reticcioli, M Setvin, U Diebold
Nature Reviews Materials 6 (7), 560-586, 2021
504 2021 Spin fluctuation induced Weyl semimetal state in the paramagnetic phase of EuCd2 As2 JZ Ma, SM Nie, CJ Yi, J Jandke, T Shang, MY Yao, M Naamneh, LQ Yan, ...
Science advances 5 (7), eaaw4718, 2019
162 2019 Polarity compensation mechanisms on the perovskite surface KTaO3 (001) M Setvin, M Reticcioli, F Poelzleitner, J Hulva, M Schmid, LA Boatner, ...
Science 359 (6375), 572-575, 2018
125 2018 Formation and dynamics of small polarons on the rutile M Reticcioli, M Setvin, M Schmid, U Diebold, C Franchini
Physical Review B 98 (4), 045306, 2018
102 2018 Interplay between Adsorbates and Polarons: CO on Rutile M Reticcioli, I Sokolović, M Schmid, U Diebold, M Setvin, C Franchini
Physical Review Letters 122 (1), 016805, 2019
98 2019 Polaron-driven surface reconstructions M Reticcioli, M Setvin, X Hao, P Flauger, G Kresse, M Schmid, U Diebold, ...
Physical Review X 7 (3), 031053, 2017
74 2017 Resolving the adsorption of molecular O2 on the rutile TiO2 (110) surface by noncontact atomic force microscopy I Sokolović, M Reticcioli, M Čalkovský, M Wagner, M Schmid, C Franchini, ...
Proceedings of the National Academy of Sciences 117 (26), 14827-14837, 2020
67 2020 Small polarons in transition metal oxides M Reticcioli, U Diebold, G Kresse, C Franchini
Handbook of Materials Modeling: Applications: Current and Emerging Materials …, 2020
63 2020 Anderson transition in stoichiometric Fe2 VAl: high thermoelectric performance from impurity bands F Garmroudi, M Parzer, A Riss, AV Ruban, S Khmelevskyi, M Reticcioli, ...
Nature Communications 13 (1), 3599, 2022
40 2022 Electron and hole doping in the relativistic Mott insulator P Liu, M Reticcioli, B Kim, A Continenza, G Kresse, DD Sarma, XQ Chen, ...
Physical Review B 94 (19), 195145, 2016
37 2016 Handbook of Materials Modeling M Reticcioli, U Diebold, G Kresse, C Franchini
Handbook of Materials Modeling(Springer International Publishing, Cham, 2020 …, 2020
30 2020 Large thermoelectric power factors by opening the band gap in semimetallic Heusler alloys F Garmroudi, M Parzer, A Riss, S Beyer, S Khmelevskyi, T Mori, ...
Materials Today Physics 27, 100742, 2022
26 2022 Electronic state unfolding for plane waves: Energy bands, Fermi surfaces, and spectral functions D Dirnberger, G Kresse, C Franchini, M Reticcioli
The Journal of Physical Chemistry C 125 (23), 12921-12928, 2021
22 2021 Competing electronic states emerging on polar surfaces M Reticcioli, Z Wang, M Schmid, D Wrana, LA Boatner, U Diebold, ...
Nature Communications 13 (1), 4311, 2022
16 2022 Modeling polarons in density functional theory: lessons learned from TiO2 M Reticcioli, U Diebold, C Franchini
Journal of Physics: Condensed Matter 34 (20), 204006, 2022
16 2022 CuAu, a hexagonal two-dimensional metal G Zagler, M Reticcioli, C Mangler, D Scheinecker, C Franchini, ...
2D Materials 7 (4), 045017, 2020
15 2020 Ru doping in iron-based pnictides: The “unfolded” dominant role of structural effects for superconductivity M Reticcioli, G Profeta, C Franchini, A Continenza
Phys. Rev. B 95 (214510), https://doi.org/10.1103/PhysRevB.95.2145, 2017
14 2017 Doping-induced insulator-metal transition in the Lifshitz magnetic insulator NaOsO3 S Dobrovits, B Kim, M Reticcioli, A Toschi, S Khmelevskyi, C Franchini
Journal of Physics: Condensed Matter 31 (24), 244002, 2019
13 2019 Machine learning for exploring small polaron configurational space VC Birschitzky, F Ellinger, U Diebold, M Reticcioli, C Franchini
npj Computational Materials 8 (1), 125, 2022
11 2022 Surface chemistry on a polarizable surface: Coupling of CO with KTaO3 (001) Z Wang, M Reticcioli, Z Jakub, I Sokolović, M Meier, LA Boatner, ...
Science Advances 8 (33), eabq1433, 2022
10 2022 
Cesare FranchiniUniversity of Vienna & University of BolognaEmail verificata su univie.ac.at