(462c) Molecular Simulation of Polyelectrolye Conformational Dynamics Under An AC Electric Field
AIChE Annual Meeting
2010
2010 Annual Meeting
2010 Annual Meeting of the American Electrophoresis Society (AES)
DNA Analysis in Microfluidic and Nanofluidic Devices
Wednesday, November 10, 2010 - 1:00pm to 1:15pm
We use a coarse-grained molecular dynamics method to study the behavior of a flexible polyelectrolyte (PE) chain in an explicit salt solution with varied valence under an AC electric field. Simulations in the absence of electric field and under DC electric field are used to determine the critical field strength and intrinsic chain relaxation frequency. Our results show that the PE chain breathes with applied AC frequency and becomes dynamically stretched, only when the applied field strength exceeds the critical field strength and the applied AC frequency is comparable to or less than the intrinsic relaxation frequency of the PE chain.