钛酸钡陶瓷的光学响应与结构之间的关系研究

基于电子结构密度的第一性原理,对钛酸钡陶瓷立方结构和四方结构的电子密度、能带结构和光学特性进行计算与比较.在低能量状态下,光响应主要是从O 2p到Ti 3d的过渡.计算结果和实验数据与其他计算方式相比具有更好的吻合性.相比较于四方结构,立方结构的所有参数值向能量值降低或者参数值增加的方向移动.     

Dimension effects on the dielectric properties of fine BaTiO3 ceramics

It is found that the core-shell structured grains are easy to produce for fine grain doped BaTiO3 ceramics in the sintering process. We study the influence of the core-shell structure on the Curie–Weiss temperature and dielectric properties of BaTiO3 ceramics by using effective medium approximation(EMA). Considering the second approximation, the dielectric properties of fine grain doped BaTiO3 ceramics are consistent with experimental data.     

Dimension effects on the dielectric properties of fine BaTi03 ceramics

It is found that the core-shell structured grains are easy to produce for fine grain doped BaTiO3 ceramics in the sintering process. We study the influence of the core-shell structure on the Curie-Weiss temperature and dielectric properties of BaTiO3 ceramics by using effective medium approximation （EMA）. Considering the second approximation, the dielectric properties of fine grain doped BaTiO3 ceramics are consistent with experimental data.