Simple analytical model of nanocluster coalescence for porous thin film design

被引:14
作者
Grammatikopoulos, P. [1 ]
Toulkeridou, E.
Nordlund, K. [2 ,3 ]
Sowwan, M. [1 ,4 ]
机构
[1] Grad Univ, Okinawa Inst Sci & Technol, Nanoparticles Design Unit, Onna, Okinawa 9040495, Japan
[2] Univ Helsinki, Dept Phys, FIN-00014 Helsinki, Finland
[3] Univ Helsinki, Helsinki Inst Phys, FIN-00014 Helsinki, Finland
[4] Al Quds Univ, Nanotechnol Res Lab, IL-51000 East Jerusalem, Israel
关键词
nanoparticles; coalescence; molecular dynamics; analytical modelling; thin films; NANOPARTICLES; SIMULATION; PHASE; BODY;
D O I
10.1088/0965-0393/23/1/015008
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
We propose an approach to coalescence studies that encompasses the random nature of nanoparticle deposition, which results in a statistical cancellation of individual sintering mechanisms. We present a rigorous, yet simple and intuitive, analytical method that describes the average coalescence behaviour of nanoparticles, regardless of constituent element or crystallinity, emphasizing only the predominant coalescence dependencies on temperature and size-dependent nanoparticle melting points. We assessed our model using molecular dynamics (MD) computer simulations of dissimilar systems, and found remarkable agreement between its predictions and the MD results. Its simplicity makes our model a suitable starting point for the development of a meso-scale simulation technique that can describe the growth of porous films and allow for their bespoke design.
引用
收藏
页数:15
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