Sharma Yamijala

Latest

• Photo-induced degradation of PFASs: Excited-state mechanisms from real-time time-dependent density functional theory
• Improved band gaps and structural properties from Wannier–Fermi–Löwdin self-interaction corrections for periodic systems
• Real-time degradation dynamics of hydrated per- and polyfluoroalkyl substances (PFASs) in the presence of excess electrons