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銀納米粒子熔化的尺寸效應(yīng)研究
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國家自然科學(xué)基金(90923041, 51275122);微系統(tǒng)與微結(jié)構(gòu)制造教育部重點(diǎn)實(shí)驗(yàn)室(哈爾濱工業(yè)大學(xué))開放基金(HIT.LOF.2011041);中央高?;究蒲袠I(yè)務(wù)費(fèi)專項(xiàng)資金 (HIT.NSRIF.201171);高等學(xué)校學(xué)科創(chuàng)新引智計(jì)劃 (B07018)


Size Effect of Melting of Silver Nanoparticles
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    摘要:

    采用分子動(dòng)力學(xué)方法對(duì)銀納米粒子進(jìn)行了熔化過程的模擬,研究分析了銀納米粒子熔化的尺寸效應(yīng)問題。仿真結(jié)果表明,銀粒子固-液相變時(shí),其系統(tǒng)勢能在某一溫度范圍內(nèi)具有明顯的突變,熔化過程類似于非晶體,并且銀納米粒子的熔化溫度明顯低于塊狀材料,隨著納米粒子尺寸的減小,其熔點(diǎn)也隨之降低,根據(jù)仿真結(jié)果及理論分析建立了納米粒子熔點(diǎn)與粒徑之間的數(shù)值關(guān)系,并分析了相關(guān)的主導(dǎo)機(jī)制。

    Abstract:

    In order to study the size effect of melting of silver nanoparticles, the melting process of silver nanoparticles of different sizes were simulated by molecular dynamics in this paper. Simulation results show that the system potential energy has an obvious mutation within a certain temperature range when solid state transforms into liquid state, which is similar to amorphous body. And, the melting temperature of nanoparticles is significantly lower than that of the bulk materials and the melting point decreases with the reduction in the size of nanoparticles. The dominant mechanism and the relationship between melting point and nanoparticle size were also analyzed.

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崔健磊,楊立軍,王 揚(yáng).銀納米粒子熔化的尺寸效應(yīng)研究[J].稀有金屬材料與工程,2014,43(2):369~374.[Cui Jianlei, Yang Lijun, Wang Yang. Size Effect of Melting of Silver Nanoparticles[J]. Rare Metal Materials and Engineering,2014,43(2):369~374.]
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  • 收稿日期:2013-01-15
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  • 在線發(fā)布日期: 2014-06-03
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