首页> 外文会议>Proceedings vol.2005-08; International Symposium on Microelectronics Technology and Devices(SBMICRO 2005); 200509; >METAL SCREENING FOR CMOS APPLICATION THROUGH AB-INITIO INTERFACE WORK FUNCTION CALCULATIONS
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METAL SCREENING FOR CMOS APPLICATION THROUGH AB-INITIO INTERFACE WORK FUNCTION CALCULATIONS

机译:通过AB-INITIO接口工作功能计算对CMOS应用进行金属筛选

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To continue the reduction of transistor dimensions in line with the historical trend the current SiO_2/polysilicon technology must be replaced by the high permissivity dielectric (high-K)/metal combination. Here we present ab-initio simulation studies performed for a variety of high-K/metal systems, which address a number of issues including the impact of interfacial oxygen in ZrO_2/Mo, the stability of the LaAlO_3/Si interfaces, and the valence band offsets of HfO_2/TiN and SiO2/TiN systems. Successful model HfO_2/Si and Al_2O_3/Si interfaces that correctly reproduce experimental data with polysilicon as the gate metal are discussed. These studies show that while vacuum work function calculations can be quite accurate, hence useful as a predictive tool, metal/dielectric interface calculations are severely limited in accuracy by the lack of experimental information on the atomistic structure of the interfaces and possibly by a limitation of density functional theory within the local density approximation.
机译:为了继续按照历史趋势减小晶体管尺寸,当前的SiO_2 /多晶硅技术必须由高介电常数的电介质(高K)/金属组合所代替。在这里,我们介绍了对各种高K /金属系统进行的从头开始的模拟研究,这些研究解决了许多问题,包括ZrO_2 / Mo中界面氧的影响,LaAlO_3 / Si界面的稳定性以及价带HfO_2 / TiN和SiO2 / TiN系统的偏移。讨论了成功模型HfO_2 / Si和Al_2O_3 / Si界面,该界面正确地再现了以多晶硅为栅金属的实验数据。这些研究表明,尽管真空功函数的计算可能非常准确,因此可用作预测工具,但由于缺乏关于界面原子结构的实验信息,并且可能由于界面的局限性,金属/电介质界面计算的准确性受到严重限制。密度泛函理论内的局部密度近似。

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