Chemistry

Simulating the ghost: quantum dynamics of the solvated electron

J. Lan, V. Kapil, et al.

This innovative research addresses the challenging nature of solvated electrons by using a machine-learning model to predict their impact on surrounding water structures. Conducted by Jinggang Lan, Venkat Kapil, Piero Gasparotto, Michele Ceriotti, Marcella Iannuzzi, and Vladimir V. Rybkin, the study successfully reproduces critical cavity structures and dynamics, paving the way for accurate insights into solvated electron behavior.