2021 Annual Meeting

Session: Computational Approaches for Studies at the Nanoscale

Chair

Nouranian, S., University of Mississippi

Presentations

01:10 PM

(299c) Molecular Dynamics Simulation of the Sintering of Titanium/Aluminum Core/Shell Nanoparticles

01:30 PM

(299d) Elucidating the Molecular Mechanism of Diffusive and Electrophoretic Ion Transport Under Single Digit Nanoconfinement

01:50 PM

(299e) High-Throughput Computational Analysis of the Role of Finite Temperature in the Optical Response of 2D Materials

02:10 PM

(299f) Ab Initio Molecular Dynamics Simulations of the Hydration of Zwitterions