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Analytical Results on Disorder effects on Polaritons and Barrier Crossing Problems
Disorder plays a significant role in the study of numerous fields of research in chemistry.
Whether it is a more that 80 years old classic problem like Kramers’ escape rate or the current interest in polaritons, disorder ...
Nonequilibrium dynamics and thermodynamics of some single-particle activity-induced diffusive systems
In the mesoscopic world, diffusion is a ubiquitous process and it is usually explained by the
Einstein’s theory of Brownian motion (BM). However, in the biological systems, some peculiar
dynamical behaviors are observed ...
Nuclear quantum effects in gas-phase systems with large amplitude motions: A study of 2-fluoroethanol, ethylene glycol, and H3O2
This thesis explores the role of nuclear quantum effects in selected systems containing
large amplitude motion through path integral simulations. Recent works have explored
molecules with such floppy modes and examined ...