A Mortar Spectral Element Method for Full-Potential Electronic Structure Calculations
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Publication:5163235
DOI10.4208/cicp.OA-2020-0020zbMath1475.65182MaRDI QIDQ5163235
Lueling Jia, Zhimin Zhang, Huajie Chen, Yichen Guo, Hui-yuan Li
Publication date: 3 November 2021
Published in: Communications in Computational Physics (Search for Journal in Brave)
Kohn-Sham equationmortar spectral element methodexponential order of convergencefull-potential calculations
Finite element, Rayleigh-Ritz and Galerkin methods for boundary value problems involving PDEs (65N30) PDEs in connection with quantum mechanics (35Q40) Numerical methods for eigenvalue problems for boundary value problems involving PDEs (65N25) Special quantum systems, such as solvable systems (81Q80)
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Uses Software
Cites Work
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