Dirac semimetal and topological phase transitions in Bi (, K, Rb) Z Wang, Y Sun, XQ Chen, C Franchini, G Xu, H Weng, X Dai, Z Fang Physical Review B—Condensed Matter and Materials Physics 85 (19), 195320, 2012 | 2226 | 2012 |
Stacking effects on the electronic and optical properties of bilayer transition metal dichalcogenides , , , and J He, K Hummer, C Franchini Physical Review B 89 (7), 075409, 2014 | 596 | 2014 |
Role of self-trapping in luminescence and -type conductivity of wide-band-gap oxides JB Varley, A Janotti, C Franchini, CG Van de Walle Physical Review B—Condensed Matter and Materials Physics 85 (8), 081109, 2012 | 579 | 2012 |
Direct View at Excess Electrons in Rutile and Anatase M Setvin, C Franchini, X Hao, M Schmid, A Janotti, M Kaltak, ... Physical review letters 113 (8), 086402, 2014 | 459 | 2014 |
Polarons in materials C Franchini, M Reticcioli, M Setvin, U Diebold Nature Reviews Materials 6 (7), 560-586, 2021 | 397 | 2021 |
Ground-state properties of multivalent manganese oxides: Density functional and hybrid density functional calculations C Franchini, R Podloucky, J Paier, M Marsman, G Kresse Physical Review B—Condensed Matter and Materials Physics 75 (19), 195128, 2007 | 366 | 2007 |
Role of polar phonons in the photo excited state of metal halide perovskites M Bokdam, T Sander, A Stroppa, S Picozzi, DD Sarma, C Franchini, ... Scientific reports 6 (1), 28618, 2016 | 291 | 2016 |
Tunable ferroelectric polarization and its interplay with spin–orbit coupling in tin iodide perovskites A Stroppa, D Di Sante, P Barone, M Bokdam, G Kresse, C Franchini, ... Nature communications 5 (1), 5900, 2014 | 283 | 2014 |
Superconducting properties of MgB2 from first principles A Floris, A Sanna, M Lüders, G Profeta, NN Lathiotakis, MAL Marques, ... Physica C: Superconductivity 456 (1-2), 45-53, 2007 | 226 | 2007 |
Screened hybrid functional applied to 33 transition-metal perovskites LaO ( = Sc–Cu): Influence of the exchange mixing parameter on the structural … J He, C Franchini Physical Review B—Condensed Matter and Materials Physics 86 (23), 235117, 2012 | 219 | 2012 |
Density functional theory study of MnO by a hybrid functional approach C Franchini, V Bayer, R Podloucky, J Paier, G Kresse Physical Review B—Condensed Matter and Materials Physics 72 (4), 045132, 2005 | 219 | 2005 |
Superconductivity in Lithium, Potassium, and Aluminum under Extreme Pressure:<? format?> A First-Principles Study G Profeta, C Franchini, NN Lathiotakis, A Floris, A Sanna, MAL Marques, ... Physical review letters 96 (4), 047003, 2006 | 197 | 2006 |
Unraveling CO adsorption on model single-atom catalysts J Hulva, M Meier, R Bliem, Z Jakub, F Kraushofer, M Schmid, U Diebold, ... Science 371 (6527), 375-379, 2021 | 196 | 2021 |
Hardness of -carbon: Density functional theory calculations XQ Chen, H Niu, C Franchini, D Li, Y Li Physical Review B—Condensed Matter and Materials Physics 84 (12), 121405, 2011 | 178 | 2011 |
Dual behavior of excess electrons in rutile TiO2 A Janotti, C Franchini, JB Varley, G Kresse, CG Van de Walle physica status solidi (RRL)–Rapid Research Letters 7 (3), 199-203, 2013 | 171 | 2013 |
Maximally localized Wannier functions in LaMnO3 within PBE+ U, hybrid functionals and partially self-consistent GW: an efficient route to construct ab initio tight-binding … C Franchini, R Kováčik, M Marsman, SS Murthy, J He, C Ederer, G Kresse Journal of Physics: Condensed Matter 24 (23), 235602, 2012 | 158 | 2012 |
Spin fluctuation induced Weyl semimetal state in the paramagnetic phase of EuCd2As2 JZ Ma, SM Nie, CJ Yi, J Jandke, T Shang, MY Yao, M Naamneh, LQ Yan, ... Science advances 5 (7), eaaw4718, 2019 | 143 | 2019 |
Hybrid functionals applied to perovskites C Franchini Journal of Physics: Condensed Matter 26 (25), 253202, 2014 | 141 | 2014 |
Local Structure and Coordination Define Adsorption in a Model Ir1/Fe3O4 Single‐Atom Catalyst Z Jakub, J Hulva, M Meier, R Bliem, F Kraushofer, M Setvin, M Schmid, ... Angewandte Chemie International Edition 58 (39), 13961-13968, 2019 | 134 | 2019 |
Behavior of Methylammonium Dipoles in MAPbX3 (X = Br and I) S Govinda, BP Kore, M Bokdam, P Mahale, A Kumar, S Pal, ... The journal of physical chemistry letters 8 (17), 4113-4121, 2017 | 130 | 2017 |