Dipolar relaxation and dielectric/piezoelectric resonance in a (001)-cut Pb(Zn1/3Nb2/3)0.9Ti0.1O3 (PZNT10%) single crystal before and after electric (E)-field poling were presented. Dielectric permittivities were meas...Dipolar relaxation and dielectric/piezoelectric resonance in a (001)-cut Pb(Zn1/3Nb2/3)0.9Ti0.1O3 (PZNT10%) single crystal before and after electric (E)-field poling were presented. Dielectric permittivities were measured as functions of temperature, frequency and poling E-field strength. Frequency-dependent dielectric spectroscopy in the poled sample exhibits multiple piezoelectric resonances between 0.1 and 1 MHz, which can be described by the forced-damped-oscillator model. The resonant spectra show significant changes while phase transitions are taking place. The unpoled crystal shows almost no optical birefringence, indicating that the average structure symmetry is isotropic. Birefringence of the crystal is significantly enhanced by a prior E-field poling.展开更多
Ba(Mg1/3Nb2/3)O3(BMN)复合钙钛矿陶瓷具有高介电常数和高品质因子等介电性能,预示了其在光学领域的应用前景.本文采用第一性原理方法计算了BMN的电子结构,对其本征光学性能进行分析和预测.对固相合成六方相BMN的XRD测试结果进行Rietvel...Ba(Mg1/3Nb2/3)O3(BMN)复合钙钛矿陶瓷具有高介电常数和高品质因子等介电性能,预示了其在光学领域的应用前景.本文采用第一性原理方法计算了BMN的电子结构,对其本征光学性能进行分析和预测.对固相合成六方相BMN的XRD测试结果进行Rietveld精修(加权方差因子Rwp=6.73%,方差因子Rp=5.05%),在此基础上建立晶体结构模型并对其进行几何优化.运用基于密度泛函理论(DFT)的平面波赝势方法,对六方相BMN晶体模型的能带、态密度和光学性质进行理论计算.结果表明BMN的能带结构为间接带隙,禁带宽度Eg=2.728 e V.Mg-O和Ba-O以离子键结合为主,Nb-O以共价键结合为主,费米面附近的能带主要由O-2p和Nb-4d态电子占据,形成了d-p轨道杂化.修正带隙后,计算了BMN沿[100]和[001]方向上的复介电函数、吸收系数和反射率等光学性质.结果表明,BMN近乎光学各向同性,在可见光区,其本征透过率为77%<T<83%,折射率为1.91<n<2.14,并伴随一定的色散现象.实验测试结果与理论计算结果相吻合.展开更多
基于Swartz and Shrout的二次合成法,采用改进的两步法,将部分原料预合成,一次烧结合成具有100%钙钛矿结构的75Pb(Zn_(1/3)Nb_(2/3))O_3-10PbTiO_3-15BaTiO_3固溶体陶瓷。首先一次性称量PbO,然后和ZnNb_2O_6混合,在660～800℃预合成,将...基于Swartz and Shrout的二次合成法,采用改进的两步法,将部分原料预合成,一次烧结合成具有100%钙钛矿结构的75Pb(Zn_(1/3)Nb_(2/3))O_3-10PbTiO_3-15BaTiO_3固溶体陶瓷。首先一次性称量PbO,然后和ZnNb_2O_6混合,在660～800℃预合成,将预合成产物粉碎后再与TiO_2和BaCO_3按化学计量称量,充分混合后,在1060～1140℃保温1～2h烧结成陶瓷试样。实验结果表明:改进的两步法工艺能够将预合成温度降为660℃,烧结温度能被拓宽到80℃获得100%钙钛矿结构的固溶体陶瓷。不同于传统的预合成和烧结,改进的两步法工艺简单、有效,在预合成阶段没有形成钙钛矿相,烧结阶段陶瓷的成瓷和致密化同时进行,完成了中间相向钙钛矿相的转变,获得了介电性能优良的陶瓷试样。展开更多
文摘Dipolar relaxation and dielectric/piezoelectric resonance in a (001)-cut Pb(Zn1/3Nb2/3)0.9Ti0.1O3 (PZNT10%) single crystal before and after electric (E)-field poling were presented. Dielectric permittivities were measured as functions of temperature, frequency and poling E-field strength. Frequency-dependent dielectric spectroscopy in the poled sample exhibits multiple piezoelectric resonances between 0.1 and 1 MHz, which can be described by the forced-damped-oscillator model. The resonant spectra show significant changes while phase transitions are taking place. The unpoled crystal shows almost no optical birefringence, indicating that the average structure symmetry is isotropic. Birefringence of the crystal is significantly enhanced by a prior E-field poling.
文摘Ba(Mg1/3Nb2/3)O3(BMN)复合钙钛矿陶瓷具有高介电常数和高品质因子等介电性能,预示了其在光学领域的应用前景.本文采用第一性原理方法计算了BMN的电子结构,对其本征光学性能进行分析和预测.对固相合成六方相BMN的XRD测试结果进行Rietveld精修(加权方差因子Rwp=6.73%,方差因子Rp=5.05%),在此基础上建立晶体结构模型并对其进行几何优化.运用基于密度泛函理论(DFT)的平面波赝势方法,对六方相BMN晶体模型的能带、态密度和光学性质进行理论计算.结果表明BMN的能带结构为间接带隙,禁带宽度Eg=2.728 e V.Mg-O和Ba-O以离子键结合为主,Nb-O以共价键结合为主,费米面附近的能带主要由O-2p和Nb-4d态电子占据,形成了d-p轨道杂化.修正带隙后,计算了BMN沿[100]和[001]方向上的复介电函数、吸收系数和反射率等光学性质.结果表明,BMN近乎光学各向同性,在可见光区,其本征透过率为77%<T<83%,折射率为1.91<n<2.14,并伴随一定的色散现象.实验测试结果与理论计算结果相吻合.
文摘基于Swartz and Shrout的二次合成法,采用改进的两步法,将部分原料预合成,一次烧结合成具有100%钙钛矿结构的75Pb(Zn_(1/3)Nb_(2/3))O_3-10PbTiO_3-15BaTiO_3固溶体陶瓷。首先一次性称量PbO,然后和ZnNb_2O_6混合,在660～800℃预合成,将预合成产物粉碎后再与TiO_2和BaCO_3按化学计量称量,充分混合后,在1060～1140℃保温1～2h烧结成陶瓷试样。实验结果表明:改进的两步法工艺能够将预合成温度降为660℃,烧结温度能被拓宽到80℃获得100%钙钛矿结构的固溶体陶瓷。不同于传统的预合成和烧结,改进的两步法工艺简单、有效,在预合成阶段没有形成钙钛矿相,烧结阶段陶瓷的成瓷和致密化同时进行,完成了中间相向钙钛矿相的转变,获得了介电性能优良的陶瓷试样。
