稀土CeO2对橡胶材料耐磨性的影响

采用干法混炼工艺在橡胶中加入不同质量分数的稀土氧化铈,研究了稀土氧化铈对橡胶耐磨性能的影响.结果表明:当稀土氧化铈的质量分数为5%～10%时,由于稀土氧化铈与橡胶混合较均匀,界面结合良好,可以使橡胶的耐磨性提高近1倍左右;当稀土氧化铈添加量超过10%后,其耐磨性能反而下降.     

Influence of Interface Structure of Co/Cu （100） Superlattices on Electronic Structure and Giant Magnetoresistance

Electronic structures and magnetoresistance （MR） of Co3 Cu5 and Co3 Cur models as well as their interface atom exchange models Co2 CuCoCu4 and Co2 CuCoCu6 are investigated by the tlrst-principles pseudopotential planewave method based on density functional theory. Charge transfer, magnetic moment, density of states, spin asymmetry factor, and MR ratio are discussed. The results show that the values of charge transfer and spin asymmetry factor at the Fermi level of Co layers are closely related to the neighbouring background of the Co layer. The Co layer with two sides adjacent to the Cu layer would transfer more charge to the Cu layer than other neighbouring background and have the largest spin asymmetry factor at the Fermi level. The Co layer with two neighbouring Co layers （interior Co） would gain a little charge and have the smallest spin asymmetry factor at the Fermi level. Two-current model is used to evaluate the MR ratio of Co2CuCoCu4 （Co2CuCoCu6） to be larger than that of Co3 Cu5 （Co3 CUT）, which can be explained by the charge transfer and spin asymmetry factor.     

Si2CN4(010)表面特性的第一性原理研究

应用第一性原理系统地研究了不同端面Si₂CN₄(010)模型的表面特性.通过3种可能表面模型解离能的比较,表明位于SiN层内的Si—NⅡ 键结合最强,而与碳二亚胺链状结构相连的Si—NⅠ 键结合最弱,因此易于形成以Si/NⅠ 键为端面的表面.文中还研究了弛豫前后表面的原子结构和电子特性,表面的NⅠ 原子容易形成新键,这是由于不饱和的NⅠ 原子在费米能级处有较高的态密度,电子结构不稳定,相反表面C原子状态较稳定,无明显的成键趋势. 关键词： 2CN₄')" href="#">Si₂CN₄ 表面 原子结构 电子结构