On simulation of Kohn-Sham and time-dependent Kohn-Sham equations
北京师范大学数学科学学院计算数学学术报告
报告题目(Title)：On simulation of Kohn-Sham and time-dependent Kohn-Sham equations
报告人(Speaker)：胡光辉 （澳门大学）
地点(Place)：电子楼 103 https://meeting.tencent.com/s/uEbw0SELrnL4 会议 ID：771 700 010
时间(Time)：2020年9月21日13:30
邀请人(Inviter)：陈华杰
报告摘要
Density functional theory has been playing an important role not only in the classical condensed physics and computational quantum chemistry, but also in emerging attosecond sciences. Robust and efficient numerical methods for the density functional theory are indispensable in the research due to the nonlinearity of the governing equations and the complex configuration of the problem. In this talk, our recent work towards developing numerical methods for the Kohn-Sham and time-dependent Kohn-Sham equations will be introduced, in which the efficiency, robustness, as well as the realization in the library AFEABIC would be described in detail with a variety of numerical examples.
