کد مقاله | کد نشریه | سال انتشار | مقاله انگلیسی | نسخه تمام متن |
---|---|---|---|---|
5417041 | 1506899 | 2010 | 13 صفحه PDF | دانلود رایگان |
عنوان انگلیسی مقاله ISI
Phase transitions, coexistence and crystal growth dynamics in ionic nanoclusters: Theory and simulation
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موضوعات مرتبط
مهندسی و علوم پایه
شیمی
شیمی تئوریک و عملی
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چکیده انگلیسی
A review of our work on phase transitions, coexistence and crystal growth dynamics in ionic nanoclusters is presented. The foundations and limitations of the proposed models are discussed and perspectives for extended treatments are given. Additionally, supported on a compilation of the asymptotic behaviour of the properties towards bulk conditions, new results concerned with the operational meaning of the thermodynamic limit are also presented. Some topics are complemented with link references to on-line animations that provide a visualisation of the focused behaviours. The simulations were carried out by molecular dynamics on KCl, NaCl, LiCl and NaI clusters.
ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Journal of Molecular Structure: THEOCHEM - Volume 946, Issues 1â3, 30 April 2010, Pages 94-106
Journal: Journal of Molecular Structure: THEOCHEM - Volume 946, Issues 1â3, 30 April 2010, Pages 94-106
نویسندگان
Pedro C.R. Rodrigues, Fernando M.S. Silva Fernandes,