| Residential College | false |
| Status | 已發表Published |
| AN ORTHOGONALIZATION-FREE PARALLELIZABLEFRAMEWORK FOR ALL-ELECTRON CALCULATIONS INDENSITY FUNCTIONAL THEORY | |
Bin Gao1; Guanghui HU2,3,4 ; Yang Kuang5; Xin Liu6
| |
| 2022-07 | |
| Source Publication | SIAM Journal on Scientific Computing
 |
| ISSN | 1064-8275 |
| Volume | 44Issue:3Pages:B723-B745 |
| Keyword | Density Functional Theory All-electron Calculations Total Energy Minimization Orthogonalization-free Scalability |
| DOI | 10.1137/20M1355884 |
| URL | View the original |
| Indexed By | SCIE |
| Language | 英語English |
| WOS Research Area | Mathematics |
| WOS Subject | Mathematics, Applied |
| Publisher | SIAM |
| Fulltext Access | |
| Citation statistics | |
| Document Type | Journal article |
| Collection | Faculty of Science and Technology DEPARTMENT OF MATHEMATICS |
| Affiliation | 1.ICTEAM Institute 2.University of Macau 3.Zhuhai UM Science & Technology Research Institute 4.Guangdong-Hong Kong-Macao Joint Laboratory for Data-Driven Fluid Mechanics and Engineering Applications, University of Macau 5.Guangdong University of Technology 6.Chinese Academy of Sciences |
| Recommended Citation GB/T 7714 | Bin Gao,Guanghui HU,Yang Kuang,et al. AN ORTHOGONALIZATION-FREE PARALLELIZABLEFRAMEWORK FOR ALL-ELECTRON CALCULATIONS INDENSITY FUNCTIONAL THEORY[J]. SIAM Journal on Scientific Computing,2022,44(3):B723-B745. |
| APA | Bin Gao,Guanghui HU,Yang Kuang,&Xin Liu.(2022).AN ORTHOGONALIZATION-FREE PARALLELIZABLEFRAMEWORK FOR ALL-ELECTRON CALCULATIONS INDENSITY FUNCTIONAL THEORY.SIAM Journal on Scientific Computing,44(3),B723-B745. |
| MLA | Bin Gao,et al."AN ORTHOGONALIZATION-FREE PARALLELIZABLEFRAMEWORK FOR ALL-ELECTRON CALCULATIONS INDENSITY FUNCTIONAL THEORY".SIAM Journal on Scientific Computing 44.3(2022):B723-B745. |
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