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1. Applications of Molecular Dynamics, Monte Carlo and Metadynamics Simulations using ReaxFF Reactive Force Fields to Fluid/Solid Interfaces

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Open Access

2. THERMAL DECOMPOSITION MECHANISM OF AQUEOUS HYDROXYLAMMONIUM NITRATE

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Open Access

3. Reaxff And eReaxff Reactive Force Field Development And Applications To Energy Storage Interfaces

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Restricted (Penn State Only)