activity
20152025
most citedHigh-throughput computational screening for solid-state Li-ion conductors

138 citations · 638 across the 15 of their papers we have counts for

collaborators

15 papers

cs.LG2025★ 2 cited

Machine Learning-based Early Detection of Potato Sprouting Using Electrophysiological Signals

Davide Andreoletti, Aris Marcolongo, Natasa Sarafijanovic Djukic +8

Accurately predicting potato sprouting before the emergence of any visual signs is critical for effective storage management, as sprouting degrades both the commercial and nutritio…

physics.comp-ph2021★ 12 cited

QEHeat: An open-source energy flux calculator for the computation of heat-transport coefficients from first principles

Aris Marcolongo, Riccardo Bertossa, Davide Tisi +1

We give a detailed presentation of the theory and numerical implementation of an expression for the adiabatic energy flux in extended systems, derived from density-functional theor…

cs.CV2020★ 8 cited

NightVision: Generating Nighttime Satellite Imagery from Infra-Red Observations

Paula Harder, William Jones, Redouane Lguensat +8

The recent explosion in applications of machine learning to satellite imagery often rely on visible images and therefore suffer from a lack of data during the night. The gap can be…

cond-mat.mtrl-sci2020★ 18 cited

Electrolytes for Li-ion all-solid-state batteries: a first-principles comparative study of Li10GeP2O12 and Li10GeP2S12 in the LISICON and LGPS phases

Giuliana Materzanini, Leonid Kahle, Aris Marcolongo +1

In this work we address Li-ion diffusion in thio-LISICON materials and in their oxide counterparts, exploring both the orthorhombic and tetragonal phases of Li10GeP2S12(LGPS) and L…

physics.comp-ph2020★ 11 cited

Spectral denoising for unsupervised analysis of correlated ionic transport

Nicola Molinari, Yu Xie, Ian Leifer +3

Computation of correlated ionic transport properties from molecular dynamics in the Green-Kubo formalism is expensive as one cannot rely on the affordable mean square displacement…

cond-mat.mtrl-sci2019★ 8 cited

The solid-state Li-ion conductor LiTaO: A combined computational and experimental study

Leonid Kahle, Xi Cheng, Tobias Binninger +8

We study the oxo-hexametallate LiTaO with first-principles and classical molecular dynamics simulations, obtaining a low activation barrier for diffusion of 0.29 eV a…