2 papers
physics.chem-ph2026
Observing Phase Space Evolution During Unimolecular Decay
Abhirami Vijayakumar, Raidel Martin Barrios, Meenu Upadhyay +4
Direct time-resolved observation of large amplitude dynamics during ground state statistical unimolecular decay remains an experimental challenge. Here, an experimental Time-Resolv…
physics.chem-ph2025
Cluster Models for Next-Generation, Machine-Learning-Based Energy Functions for Molecular Simulations
JingChun Wang, Meenu Upadhyay, Eric D. Boittier +7
Energy functions for pure and heterogenous systems are one of the backbones for molecular simulation of condensed phase systems. With the advent of machine learned potential energy…