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Annealing effects on the structural and dielectric properties of (Nb + In) co-doped rutile TiO2 ceramics

机译:退火对(Nb + In)共掺杂金红石型TiO2陶瓷的结构和介电性能的影响

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Density functional theory calculations were conducted to investigate the electronic structures of rutile Ti _(16) O _(32) , Ti _(13) Nb _(2) InO _(32) , and Ti _(13) Nb _(2) InO _(31) systems. High density (Nb + In) co-doped rutile TiO _(2) ceramics were successfully prepared by one modified solid state method. XRD, XPS, Raman scattering and FT-IR measurements were performed to investigate the structural properties of the (Nb + In) co-doped rutile TiO _(2) ceramics annealed in different atmospheres. The lattice parameters for the (Nb + In) co-doped rutile TiO _(2) ceramics were enlarged slightly after they were annealed in air and oxygen. Raman scattering results indicate that the E _(g) modes are quite sensitive to oxygen vacancy in comparison with the other Raman active modes. The ceramics annealed in oxygen at 873 K exhibit the best dielectric performance with giant dielectric permittivity (>14?000) and small dielectric loss (<0.2) over the frequency range from 40 Hz to 1 MHz.
机译:进行密度泛函理论计算以研究金红石型Ti _(16)O _(32),Ti _(13)Nb _(2)InO _(32)和Ti _(13)Nb _(2)的电子结构)InO _(31)系统。一种改进的固态方法成功地制备了高密度(Nb + In)共掺杂的金红石型TiO_(2)陶瓷。进行了XRD,XPS,拉曼散射和FT-IR测量,以研究在不同气氛下退火的(Nb + In)共掺杂金红石型TiO _(2)陶瓷的结构性能。 (Nb + In)共掺杂金红石型TiO __(2)陶瓷在空气和氧气中退火后,其晶格参数略有增大。拉曼散射结果表明,与其他拉曼活性模式相比,E _(g)模式对氧空位非常敏感。在873 K的氧气中退火的陶瓷表现出最佳的介电性能,在40 Hz至1 MHz的频率范围内具有极高的介电常数(> 14?000)和小的介电损耗(<0.2)。

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