CE 530 Molecular Simulation
Review
Capacitors
Dielectrics
Polarization
Origins of Polarization
Polarization Charges
Surface Charge
Electrostatic Equations for Dielectrics 1.
Electrostatic Equations for Dielectrics
Thermodynamics and Dielectric Phenomena
Simple Averages 4. Heat Capacity (from Lecture 6)
Statistical Mechanics and Dielectric Phenomena
Connection to Ewald Sum
Boundary Conditions for Ewald Sum
Boundary Contribution to Hamiltonian
Reaction Field Method
Summary
Email: kofke@eng.buffalo.edu
Home Page: http://www.cheme.buffalo.edu/courses/ce530
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