Author
Chenxi Nie
0 works0 citations
Recent research
- Physics & Space
How Ions Reshape the Infrared Spectra of Aqueous NaCl
Abstract Infrared (IR) spectroscopy probes the hydrogen-bond structure of electrolyte solutions, yet relating spectra to molecular mechanisms is challenging. We combine machine-learning molecular dynamics with a deep Wannier model to compute concentration-dependent IR spectra of...