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Alessio Gagliardi
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Dye-sensitized solar cells under ambient light powering machine learning: towards autonomous smart sensors for the internet of things
H Michaels, M Rinderle, R Freitag, I Benesperi, T Edvinsson, R Socher, ...
Chemical Science 11 (11), 2895-2906, 2020
2252020
Resonant electron heating and molecular phonon cooling in single C 60 junctions
G Schulze, KJ Franke, A Gagliardi, G Romano, CS Lin, AL Rosa, ...
Physical review letters 100 (13), 136801, 2008
1532008
Understanding the inelastic electron-tunneling spectra of alkanedithiols on gold
GC Solomon, A Gagliardi, A Pecchia, T Frauenheim, A Di Carlo, ...
The Journal of chemical physics 124 (9), 2006
1292006
Incoherent Electron− Phonon Scattering in Octanethiols
A Pecchia, A Di Carlo, A Gagliardi, S Sanna, T Frauenheim, R Gutierrez
Nano letters 4 (11), 2109-2114, 2004
1292004
Tuning halide perovskite energy levels
L Canil, T Cramer, B Fraboni, D Ricciarelli, D Meggiolaro, A Singh, M Liu, ...
Energy & Environmental Science 14 (3), 1429-1438, 2021
1212021
Optimizing the size of platinum nanoparticles for enhanced mass activity in the electrochemical oxygen reduction reaction
B Garlyyev, K Kratzl, M Rück, J Michalička, J Fichtner, JM Macak, T Kratky, ...
Angewandte Chemie International Edition 58 (28), 9596-9600, 2019
1122019
A priori method for propensity rules for inelastic electron tunneling spectroscopy of single-molecule conduction
A Gagliardi, GC Solomon, A Pecchia, T Frauenheim, A Di Carlo, NS Hush, ...
Physical Review B 75 (17), 174306, 2007
942007
Mesoporous electron-selective contacts enhance the tolerance to interfacial ion accumulation in perovskite solar cells
A Gagliardi, A Abate
ACS Energy Letters 3 (1), 163-169, 2017
562017
Molecular origins of conduction channels observed in shot-noise measurements
GC Solomon, A Gagliardi, A Pecchia, T Frauenheim, A Di Carlo, ...
Nano letters 6 (11), 2431-2437, 2006
532006
Influence of the interface material layers and semiconductor energetic disorder on the open circuit voltage in polymer solar cells
A Zampetti, AH Fallahpour, M Dianetti, L Salamandra, F Santoni, ...
Journal of Polymer Science Part B: Polymer Physics 53 (10), 690-699, 2015
492015
Electronic and transport properties of silicon nanowires
F Sacconi, MP Persson, M Povolotskyi, L Latessa, A Pecchia, A Gagliardi, ...
Journal of Computational Electronics 6, 329-333, 2007
482007
Generalized kinetic Monte Carlo framework for organic electronics
W Kaiser, J Popp, M Rinderle, T Albes, A Gagliardi
Algorithms 11 (4), 37, 2018
472018
Heating and cooling mechanisms in single-molecule junctions
G Romano, A Gagliardi, A Pecchia, A Di Carlo
Physical Review B 81 (11), 115438, 2010
472010
Oxygen reduction reaction: Rapid prediction of mass activity of nanostructured platinum electrocatalysts
M Rück, A Bandarenka, F Calle-Vallejo, A Gagliardi
The journal of physical chemistry letters 9 (15), 4463-4468, 2018
462018
The symmetry of single-molecule conduction
GC Solomon, A Gagliardi, A Pecchia, T Frauenheim, A Di Carlo, ...
The Journal of chemical physics 125 (18), 2006
452006
Machine learning stability and bandgaps of lead‐free perovskites for photovoltaics
JC Stanley, F Mayr, A Gagliardi
Advanced Theory and Simulations 3 (1), 1900178, 2020
442020
Machine learning–based charge transport computation for pentacene
J Lederer, W Kaiser, A Mattoni, A Gagliardi
Advanced Theory and Simulations 2 (2), 1800136, 2019
442019
Charge carrier mobility of disordered organic semiconductors with correlated energetic and spatial disorder
W Kaiser, T Albes, A Gagliardi
Physical Chemistry Chemical Physics 20 (13), 8897-8908, 2018
432018
Modeling and simulation of energetically disordered organic solar cells
AH Fallahpour, A Gagliardi, F Santoni, D Gentilini, A Zampetti, ...
Journal of Applied Physics 116 (18), 2014
432014
The green's function density functional tight-binding (gDFTB) method for molecular electronic conduction
JR Reimers, GC Solomon, A Gagliardi, A Bilić, NS Hush, T Frauenheim, ...
The Journal of Physical Chemistry A 111 (26), 5692-5702, 2007
422007
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