| Predicting magnetism: Self-interaction correction scheme A Droghetti, CD Pemmaraju, S Sanvito Physical Review B—Condensed Matter and Materials Physics 78 (14), 140404, 2008 | 155 | 2008 |
| Assessment of density functional theory for iron (II) molecules across the spin-crossover transition A Droghetti, D Alfè, S Sanvito The Journal of chemical physics 137 (12), 124303, 2012 | 121 | 2012 |
| Robust Organic Radical Molecular Junctions Using Acetylene Terminated Groups for C–Au Bond Formation F Bejarano, IJ Olavarria-Contreras, A Droghetti, I Rungger, A Rudnev, ... Journal of the American Chemical Society 140 (5), 1691-1696, 2018 | 95 | 2018 |
| Electric field control of valence tautomeric interconversion in Cobalt dioxolene A Droghetti, S Sanvito Physical review letters 107 (4), 047201, 2011 | 85 | 2011 |
| Electron doping and magnetic moment formation in N-and C-doped MgO A Droghetti, S Sanvito Applied Physics Letters 94 (25), 252505, 2009 | 81 | 2009 |
| Polaronic distortion and vacancy-induced magnetism in MgO A Droghetti, CD Pemmaraju, S Sanvito Physical Review B—Condensed Matter and Materials Physics 81 (9), 092403, 2010 | 78 | 2010 |
| Dynamic spin filtering at the Co/Alq3 interface mediated by weakly coupled second layer molecules A Droghetti, P Thielen, I Rungger, N Haag, N Großmann, J Stöckl, ... Nature Communications 7 (1), 12668, 2016 | 68 | 2016 |
| Controlling the Spin Texture of Topological Insulators by Rational Design of Organic Molecules S Jakobs, A Narayan, B Stadtmüller, A Droghetti, I Rungger, YS Hor, ... Nano letters 15 (9), 6022-6029, 2015 | 57 | 2015 |
| Electronic and magnetic properties of the interface between metal-quinoline molecules and cobalt A Droghetti, S Steil, N Großmann, N Haag, H Zhang, M Willis, WP Gillin, ... Physical Review B 89 (9), 094412, 2014 | 56 | 2014 |
| Nonlocally sensing the magnetic states of nanoscale antiferromagnets with an atomic spin sensor S Yan, L Malavolti, JAJ Burgess, A Droghetti, A Rubio, S Loth Science Advances 3 (5), e1603137, 2017 | 51 | 2017 |
| Quantum transport simulation scheme including strong correlations and its application to organic radicals adsorbed on gold A Droghetti, I Rungger Physical Review B 95, 085131, 2017 | 49 | 2017 |
| Stable anchoring chemistry for room temperature charge transport through graphite-molecule contacts AV Rudnev, V Kaliginedi, A Droghetti, H Ozawa, A Kuzume, M Haga, ... Science Advances 3 (6), e1602297, 2017 | 45 | 2017 |
| MgN: A possible material for spintronic applications A Droghetti, N Baadji, S Sanvito Physical Review B—Condensed Matter and Materials Physics 80 (23), 235310, 2009 | 37 | 2009 |
| Predicting the conductance of strongly correlated molecules: the Kondo effect in perchlorotriphenylmethyl/Au junctions WH Appelt, A Droghetti, L Chioncel, MM Radonjić, E Muñoz, S Kirchner, ... Nanoscale 10 (37), 17738-17750, 2018 | 34 | 2018 |
| Diffusion Monte Carlo Perspective on the Spin-State Energetics of [Fe (NCH) 6] 2+ M Fumanal, LK Wagner, S Sanvito, A Droghetti Journal of Chemical Theory and Computation 12 (9), 4233-4241, 2016 | 34 | 2016 |
| Transmission through correlated Cu CoCu heterostructures L Chioncel, C Morari, A Östlin, WH Appelt, A Droghetti, MM Radonjić, ... Physical Review B 92 (5), 054431, 2015 | 25 | 2015 |
| Spin-dependent electronic structure of the Co/Al (OP) 3 interface S Müller, S Steil, A Droghetti, N Großmann, V Meded, A Magri, B Schäfer, ... New Journal of Physics 15 (11), 113054, 2013 | 25 | 2013 |
| Ground state of a spin-crossover molecule calculated by diffusion Monte Carlo A Droghetti, D Alfe, S Sanvito Physical Review B—Condensed Matter and Materials Physics 87 (20), 205114, 2013 | 23 | 2013 |
| Ab initio transport across bismuth selenide surface barriers A Narayan, I Rungger, D Andrea, S Sanvito Physical Review B 90 (20), 205431, 2014 | 21 | 2014 |
| Fundamental gap of molecular crystals via constrained density functional theory A Droghetti, I Rungger, C Das Pemmaraju, S Sanvito Physical Review B 93 (19), 195208, 2016 | 20 | 2016 |
