Eliminating the Pre-exponential Factor in Classical Nucleation Theory
نویسندگان
چکیده
منابع مشابه
Systematic improvement of classical nucleation theory.
We reconsider the applicability of classical nucleation theory (CNT) to the calculation of the free energy of solid cluster formation in a liquid and its use to the evaluation of interface free energies from nucleation barriers. Using two different freezing transitions (hard spheres and NaCl) as test cases, we first observe that the interface-free-energy estimates based on CNT are generally in ...
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In this paper we introduce a new method to design interparticle interactions to target arbitrary crystal structures via the process of self-assembly. We show that it is possible to exploit the slope of the crystal nucleation free-energy barrier to sample and select optimal interparticle interactions for self-assembly into a desired structure. We apply this method to find interactions to target ...
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ژورنال
عنوان ژورنال: Chemical Science International Journal
سال: 2019
ISSN: 2456-706X
DOI: 10.9734/csji/2019/v28i330140