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Effect of pressure on nanomaterials

机译:压力对纳米材料的影响

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摘要

A simple theory is proposed to predict the effect of pressure on nanomaterials, which gets support from the Mie-Gruneisen theory of thermal expansivity as formulated by Born and Huang. We considered LiAlSi _2O_6 to study the effect of pressure in the light of other formulations, viz. Murnaghan, BirchMumaghan, Vinet and Kumar. The results obtained are found to present a good agreement with the experimental data as well as other formulations. To confirm the validity of the formulation, we applied the method to study the compression behaviour of a number of nanomaterials, viz. CdSe, Rb_3C_(60), Ni(20 nm), carbon nanotube, γ-Fe_2O_3, ε-Fe (Hexagonal iron), MgO, CuO, γ-Al_2O_3 (67 nm), α-Fe_2O _3, α-Fe (filled nanotube), TiO_2 (anatase), 3C-SiC (30 nm), TiO_2 (rutile phase), Zr_(0.1)Ti_(0.9)O _2, AlN (hexagonal), γ-Si_3N_4, Ni-filled MWCNT and Fe-filled MWCNT. The results obtained are compared with the experimental data. A good agreement between theory and experiment demonstrates the validity of the present approach.
机译:提出了一种简单的理论来预测压力对纳米材料的影响,该理论得到了Born和Huang提出的Mie-Gruneisen热膨胀理论的支持。我们考虑使用LiAlSi _2O_6来研究压力根据其他配方的影响。 Murnaghan,BirchMumaghan,Vinet和Kumar。发现获得的结果与实验数据以及其他配方呈现出良好的一致性。为了确认该配方的有效性,我们应用了该方法来研究多种纳米材料的压缩行为,即。 CdSe,Rb_3C_(60),Ni(20 nm),碳纳米管,γ-Fe_2O_3,ε-Fe(六角铁),MgO,CuO,γ-Al_2O_3(67 nm),α-Fe_2O_3,α-Fe(填充纳米管),TiO_2(锐钛矿),3C-SiC(30 nm),TiO_2(金红石相),Zr_(0.1)Ti_(0.9)O _2,AlN(六方),γ-Si_3N_4,Ni填充的MWCNT和Fe填充的碳纳米管将获得的结果与实验数据进行比较。理论与实验之间的良好一致性证明了该方法的有效性。

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