Publications (4)
The Phase Diagram of Carbon Dioxide from Correlation Functions and a Many-body Potential
Amanda A. Chen, Alexandria Do, Tod A. Pascal
The phase stability and equilibria of carbon dioxide is investigated from 125 -- 325K and 1 -- 10,000 atm using extensive molecular dynamics (MD) simulations and the Two-Phase Ther…
Molecular-Scale Visualization of Steric Effects of Ligand Binding to Reconstructed Au(111) Surfaces
Liya Bi, Sasawat Jamnuch, Amanda Chen +10
Direct imaging of single molecules at nanostructured interfaces is a grand challenge, with potential to enable new, precise material architectures and technologies. Of particular i…
Spectroscopic Determination of Site-Selective Ligand Binding on Single Anisotropic Nanocrystals
Dong Le, Wade Shipley, Alexandria Do +17
Organic surface ligands are integral components of nanocrystals and nanoparticles that have a strong influence on their physicochemical properties, their interaction with the envir…
Molecular-Scale Insights into the Heterogeneous Interactions Between an m-Terphenyl Isocyanide Ligand and Noble Metal Nanoparticles
Liya Bi, Yufei Wang, Zhe Wang +8
The structural and chemical properties of metal nanoparticles are often dictated by their interactions with molecular ligand shells. These interactions are highly material-specific…