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Alys Hugo

Institution
Pacific Northwest National Laboratory

Projects

Modeling charge transport and interfacial chemistry at the nanoscale

Lead Institution
Pacific Northwest National Laboratory
Principal Investigator
Ram Devanathan
Project type
Large-Scale EMSL Research
Understanding charge transfer, charge transport and molecular transport in nanomaterials and interfaces in solids (such as grain boundaries, interfaces in multilayer materials, and hydrophilic…

Advanced Biomolecular Simulations - Development and Applications

Lead Institution
Oak Ridge National Laboratory
Principal Investigator
T. Straatsma
Project type
Capability Research
This project focuses on two important components of biomolecular modeling and simulation: i) the development of novel molecular modeling capabilities and their efficient parallel implementations, and…