Now showing items 11-13 of 13
Linear response properties of nonconducting periodic systems from first principles
This work is devoted to extending Kohn-Sham density functional theory (KS-DFT) with Gaussian-type orbitals (GTOs) and periodic boundary conditions (PBC) to linear response properties of nonconducting periodic systems, ...
Manipulation of gold nanorod surfaces with self-assembled monolayers
Gold nanorods exhibit spectral peaks due to localized surface plasmon resonances (LSPR) which are sensitive to the optical properties of their environment. Accordingly, molecular binding to the surface of gold nanorods ...
Towards large scale production and separation of carbon nanotubes
Since their discovery, carbon nanotubes (CNTs) have boosted the research and applications of nanotechnology; however, many applications of CNTs are inaccessible because they depend upon large-scale CNT production and ...