UM  > Faculty of Science and Technology  > DEPARTMENT OF MATHEMATICS
Residential Collegefalse
Status已發表Published
On accelerating a multilevel correction adaptive finite element method for Kohn-Sham equation
Hu, Guanghui1,2; Xie, Hehu3,4; Xu, Fei5
2023
Source PublicationJournal of Computational Physics
ISSN0021-9991
Volume472
Abstract

Based on the numerical method proposed in Hu et al. (2018) [22] for Kohn-Sham equation, further improvement on the efficiency is obtained in this paper by i). designing a numerical method with the strategy of separately handling the nonlinear Hartree potential and exchange-correlation potential, and ii). parallelizing the algorithm in an eigenpairwise approach. The feasibility of two approaches is analyzed in detail, and the new algorithm is described completely. Compared with previous results, a significant improvement of numerical efficiency can be observed from plenty of numerical experiments, which make the new method more suitable for the practical problems.

KeywordFinite Element Method Kohn-sham Equation Multilevel Correction Method Parallel Computing Separately Handing Nonlinear Terms
DOI10.1016/j.jcp.2022.111674
URLView the original
Indexed BySCIE
Language英語English
WOS Research AreaComputer Science ; Physics
WOS SubjectComputer Science, Interdisciplinary Applications ; Physics, Mathematical
PublisherAcademic Press Inc.
Scopus ID2-s2.0-85140243252
Fulltext Access
Citation statistics
Document TypeJournal article
CollectionDEPARTMENT OF MATHEMATICS
Corresponding AuthorXu, Fei
Affiliation1.Department of Mathematics & Guangdong-Hong Kong-Macao Joint Laboratory for Data-Driven Fluid Mechanics and Engineering Applications, Faculty of Science and Technology, University of Macau, Macao
2.Zhuhai UM Science & Technology Research Institute, Zhuhai, Guangdong, China
3.LSEC, ICMSEC, Academy of Mathematics and Systems Science, Chinese Academy of Sciences, Beijing, 100190, China
4.School of Mathematical Sciences, University of Chinese Academy of Sciences, Beijing, 100049, China
5.Faculty of Science, Beijing University of Technology, Beijing, 100124, China
First Author AffilicationFaculty of Science and Technology
Recommended Citation
GB/T 7714
Hu, Guanghui,Xie, Hehu,Xu, Fei. On accelerating a multilevel correction adaptive finite element method for Kohn-Sham equation[J]. Journal of Computational Physics, 2023, 472.
APA Hu, Guanghui., Xie, Hehu., & Xu, Fei (2023). On accelerating a multilevel correction adaptive finite element method for Kohn-Sham equation. Journal of Computational Physics, 472.
MLA Hu, Guanghui,et al."On accelerating a multilevel correction adaptive finite element method for Kohn-Sham equation".Journal of Computational Physics 472(2023).
Files in This Item:
There are no files associated with this item.
Related Services
Recommend this item
Bookmark
Usage statistics
Export to Endnote
Google Scholar
Similar articles in Google Scholar
[Hu, Guanghui]'s Articles
[Xie, Hehu]'s Articles
[Xu, Fei]'s Articles
Baidu academic
Similar articles in Baidu academic
[Hu, Guanghui]'s Articles
[Xie, Hehu]'s Articles
[Xu, Fei]'s Articles
Bing Scholar
Similar articles in Bing Scholar
[Hu, Guanghui]'s Articles
[Xie, Hehu]'s Articles
[Xu, Fei]'s Articles
Terms of Use
No data!
Social Bookmark/Share
All comments (0)
No comment.
 

Items in the repository are protected by copyright, with all rights reserved, unless otherwise indicated.