First-principles study of magnetic properties of stoichiometric and O deficient low-index surfaces of rutile SnO2 and TiO2

被引:0
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作者
Han, Ruilin [1 ]
Yang, Hui [1 ]
Wang, Dingdi [2 ]
Du, Xiaobo [1 ]
Yan, Yu [1 ]
机构
[1] Key Laboratory of Physics and Technology for Advanced Batteries (Ministry of Education), Department of Physics, Jilin University, Changchun 130012, China
[2] Department of Physics, Hong Kong University of Science and Technology, Clear Water Bay, Kowloon, Hong Kong
关键词
Compilation and indexing terms; Copyright 2025 Elsevier Inc;
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学科分类号
摘要
Calculations - Defect states - Ferromagnetism - Electronic structure - Magnetic moments - Oxide minerals - Magnetic properties - Titanium - Atoms - Magnetic couplings - Vacancies
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页码:197 / 204
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