362 citations · 725 across the 11 of their papers we have counts for
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physics.chem-ph2024★ 4 cited
A Bond-Based Machine Learning Model for Molecular Polarizabilities and A Priori Raman Spectra
Jakub K. Sowa, Peter J. Rossky
The use of machine learning (ML) algorithms in molecular simulations has become commonplace in recent years. There now exists, for instance, a multitude of ML force field algorithm…
physics.chem-ph2024★ 9 cited
IR Spectroscopy of Carboxylate-Passivated Semiconducting Nanocrystals: Simulation and Experiment
Jakub K. Sowa, Danielle M. Cadena, Arshad Mehmood +3
Surfaces of colloidal nanocrystals are frequently passivated with carboxylate ligands which exert significant effects on their optoelectronic properties and chemical stability. Exp…