کد مقاله کد نشریه سال انتشار مقاله انگلیسی نسخه تمام متن
1594864 1515710 2008 6 صفحه PDF دانلود رایگان
عنوان انگلیسی مقاله ISI
Modeling the cohesive energy and melting point of nanoparticles by their average coordination number
موضوعات مرتبط
مهندسی و علوم پایه مهندسی مواد دانش مواد (عمومی)
پیش نمایش صفحه اول مقاله
Modeling the cohesive energy and melting point of nanoparticles by their average coordination number
چکیده انگلیسی

We present a relation between the average coordination number and the cohesive energy for nanoparticles that shows that the ratio of nanoparticles cohesive energy to the bulk value is equal to the ratio of the nanoparticles average coordination number to that of the bulk. We consider the effect of lattice and surface packing factors on the average coordination numbers of the atoms in the nanoparticle. The melting temperature of nanoparticles has been calculated from the obtained relation for cohesive energy, and predictions for the cohesive energy and melting temperature of the nanoparticles have been compared with other theoretical models and available experimental data and the results of molecular dynamics simulations.

ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Solid State Communications - Volume 145, Issues 9–10, March 2008, Pages 432–437
نویسندگان
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