UM E-Theses Collection (澳門大學電子學位論文庫)
- Title
-
An adaptive finite element method for Kohn-Sham equation with multilevel correction
- English Abstract
-
Show / Hidden
In this thesis, we introduce an adaptive finite element method for solving the KohnSham equation. With this new method, solving the Kohn-Sham equation is transformed to solve a series of boundary value problems on multilevel finite element spaces and a series of nonlinear eigenvalue problems on the coarsest finite element spaces. Based on this method, a priori estimate for the eigenpair approximation and the residual method a posteriori error estimation for the Kohn-Sham model are used to refine the mesh and improve the accuracy. In all, the proposed adaptive finite element method can improve the overall efficiency for solving nonlinear eigenvalue problem .
- Issue date
-
2015.
- Author
-
Shen, Ye Dan
- Faculty
- Faculty of Science and Technology
- Department
- Department of Mathematics
- Degree
-
M.Sc.
- Subject
-
Finite element method
Density functionals
- Supervisor
-
Hu, Guang Hui
- Files In This Item
- Location
- 1/F Zone C
- Library URL
- 991000749849706306