55 citations · 107 across the 9 of their papers we have counts for
11 papers
Machine-Learning-Optimized Perovskite Nanoplatelet Synthesis
Carola Lampe, Ioannis Kouroudis, Milan Harth +3
With the demand for renewable energy and efficient devices rapidly increasing, a need arises to find and optimize novel (nano)materials. This can be an extremely tedious process, o…
Defect Spectroscopy and Non-Ionizing Energy Loss Analysis of Proton and Electron Irradiated p-type GaAs Solar Cells
Carmine Pellegrino, Alessio Gagliardi, Claus G. Zimmermann
This article may be downloaded for personal use only. Any other use requires prior permission of the author and AIP Publishing. This article appeared in Journal of Applied Physics…
Global property prediction: A benchmark study on open source, perovskite-like datasets
Felix Mayr, Alessio Gagliardi
Screening combinatorial space for novel materials - such as perovskite-like ones for photovoltaics - has resulted in a high amount of simulated high-troughput data and analysis the…
Non-equilibrium thermodynamics of charge separation in organic solar cells
Waldemar Kaiser, Veljko Jankovic, Nenad Vukmirovic +1
This work presents a novel theoretical description of the non-equilibrium thermodynamics of charge separation process in organic solar cells (OSCs). Using the theory of stochastic…
Oxygen Reduction Reaction: Rapid Prediction of Mass Activity of Unstrained Nanostructured Platinum Electrocatalysts
Marlon Rueck, Aliaksandr Bandarenka, Federico Calle-Vallejo +1
Tailored Pt nanoparticle catalysts are promising candidates to accelerate the oxygen reduction reaction (ORR) in fuel cells. However, the search for active nanoparticle catalysts i…
Large deviation theory to model systems under an external feedback
Alessio Gagliardi, Alessandro Pecchia, Aldo Di Carlo
In this paper we address the problem of systems under an external feedback. This is performed using a large deviation approach and rate distortion from information theory. In parti…
Single-molecule Electronics: Cooling Individual Vibrational Modes by the Tunneling Current
Jacob Lykkebo, Giuseppe Romano, Alessio Gagliardi +2
Electronic devices composed of single molecules constitute the ultimate limit in the continued downscaling of electronic components. A key challenge for single-molecule electronics…
How to reconcile Information theory and Gibbs-Herz entropy for inverted populated systems
Alessio Gagliardi, Alessandro Pecchia
In this paper we discuss about the validity of the Shannon entropy functional in connection with the correct Gibbs-Hertz probability distribution function. We show that there is no…
IETS and quantum interference: propensity rules in the presence of an interference feature
Jacob Lykkebo, Alessio Gagliardi, Alessandro Pecchia +1
Destructive quantum interference in single molecule electronics is an intriguing phe- nomenon; however, distinguishing quantum interference effects from generically low transmissio…
Free energy potential and temperature with information exchange
Alessio Gagliardi, Aldo Di Carlo
In this paper we develop a generalized formalism for equilibrium thermodynamic systems when an information is shared between the system and the reservoir. The information results i…
Kinetic and thermodynamic temperatures in quantum systems
Alessio Gagliardi, Alessandro Pecchia, Aldo Di Carlo
In this work we present a formalism to describe non equilibrium conditions in systems with a discretized energy spectrum, such as quantum systems. We develop a formalism based on a…