1 citations · 1 across the 1 of their papers we have counts for
Showing cond-mat.mtrl-sciShow all
2 papers · 1 filter
cond-mat.mtrl-sci2025
Investigating Anharmonicities in Polarization-Orientation Raman Spectra of Acene Crystals with Machine Learning
Paolo Lazzaroni, Shubham Sharma, Mariana Rossi
We present a first-principles machine-learning computational framework to investigate anharmonic effects in polarization-orientation (PO) Raman spectra of molecular crystals, focus…
cond-mat.mtrl-sci2024★ 1 cited
Frontier orbitals control dynamical disorder in molecular semiconductors
Alexander Neef, Sebastian Hammer, Yuxuan Yao +11
Charge transport in organic semiconductors is limited by dynamical disorder. Design rules for new high-mobility materials have therefore focused on limiting its two foundations: st…