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《Simulations Moléculaires》Cours04IIIb

How to start up? Initial configuration: Criteria for choosing initial configuration: quick relaxation to the equilibrium state. Random initial configuration: Advantage: liquid-like, easy to generate. Drawback: substantial overlaps at high densities. Use: Monte-Carlo for systems without hard-core interactions. Not suitable for hard-core interactions and MD at high densities.
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