96 citations · 181 across the 6 of their papers we have counts for
6 papers
The interplay of interfaces, supramolecular assembly, and electronics in organic semiconductors
Belinda J. Boehm, Huong T. L. Nguyen, David M. Huang
Organic semiconductors, which include a diverse range of carbon-based small molecules and polymers with interesting optoelectronic properties, offer many advantages over convention…
Anisotropic molecular coarse-graining by force and torque matching with neural networks
Marltan O. Wilson, David M. Huang
We develop a machine-learning method for coarse-graining condensed-phase molecular systems using anisotropic particles. The method extends currently available high-dimensional neur…
Pressure Induced Enlargement and Ionic Current Rectification in Symmetric Nanopores
Sebastian J. Davis, Michal Macha, Andrey Chernev +3
Nanopores in solid state membranes are a tool able to probe nanofluidic phenomena or can act as a single molecular sensor. They also have diverse applications in filtration, desali…
Entrance Effects in Concentration-Gradient-Driven Flow Through an Ultrathin Porous Membrane
Daniel J. Rankin, Lydéric Bocquet, David M. Huang
Transport of liquid mixtures through porous membranes is central to processes such as desalination, chemical separations and energy harvesting, with ultrathin membranes made from n…
Molecular shape and the energetics of chemisorption: From simple to complex energy landscapes
David M. Huang, Peter Harrowell
We enumerate all local minima of the energy landscape for model rigid adsorbates characterized by three or four equivalent binding sites (e.g., thiol groups) on a close-packed (111…
Ion specificity and anomalous electrokinetic effects in hydrophobic nanochannels
David M. Huang, Cecile Cottin-Bizonne, Christophe Ybert +1
We demonstrate with computer simulations that anomalous electrokinetic effects, such as ion specificity and non-zero zeta potentials for uncharged surfaces, are generic features of…