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Atomistic Simulation Of Desalination, Ian David Durr

Symposium of Student Scholars

Atomistic Simulation of Desalination

Ian Durr, Matheus Prates, and Jungkyu Park

Kennesaw State University

In this research, we investigate the desalination capacity of three-dimensional (3D) carbon nanostructures using molecular dynamics simulations. 3D carbon nanostructures proposed here will filter seawater efficiently because of their multiple layers with holes of tunable sizes. The structure is designed to be flexible, allowing mechanical deformation during daily use. The 3D carbon nanostructure will still possess high thermal conductivity, enabling easy recycle through a simple heating process. Here, we employ LAMMPS, Large-scale Atomic/MolecularMassively Parallel Simulator distributed by Sandia National Laboratories to measure salt ion flux through …