Thursday, 12 June, 2014, 09:02
Posted by Krzysztof Glowinski
I May I was studying various models which linkPosted by Krzysztof Glowinski
macroscopic boundary parameters to energies of boundaries.
I've written a piece of software that
assumes an energy function with some free parameters
and tries to fit the model to data from
molecular simulations available in literature.
This will allow for determination which model
describes best the relationship between geometry and energy.
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