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The last 5 uploaded publications
Accurate Electron-phonon Interactions from Advanced Density Functional Theory
Yanyong Wang, Manuel Engel, Christopher Lane, Henrique Miranda, Lin Hou, B. Barbiellini, R. S. Markiewicz, Jian‐Xin Zhu, Kresse Georg, Arun Bansil, Jianwei Sun, Ruiqi Zhang (2024). Accurate Electron-phonon Interactions from Advanced Density Functional Theory. arXiv (Cornell University), DOI: 10.48550/arxiv.2411.08192.
Preprint397 days agoMagnetism-Enhanced Strong Electron-Phonon Coupling in Infinite-Layer Nickelate
Ruiqi Zhang, Yanyong Wang, Manuel Engel, Christopher Lane, Henrique Miranda, Sugata Chowdhury, Bahadur Singh, B. Barbiellini, Jian‐Xin Zhu, R. S. Markiewicz, E. K. U. Gross, Kresse Georg, Arun Bansil, Jianwei Sun (2025). Magnetism-Enhanced Strong Electron-Phonon Coupling in Infinite-Layer Nickelate. , DOI: https://doi.org/10.48550/arxiv.2504.13025.
Preprint132 days agoCapturing the electron–electron cusp with the coupling-constant averaged exchange–correlation hole: A case study for Hooke’s atoms
Lin Hou, Tom J. P. Irons, Yanyong Wang, James W. Furness, Andrew M. Teale, Jianwei Sun (2024). Capturing the electron–electron cusp with the coupling-constant averaged exchange–correlation hole: A case study for Hooke’s atoms. , 160(1), DOI: https://doi.org/10.1063/5.0173370.
Article51 days agoAb Initio Calculation of Coupling-Constant Averaged Exchange–Correlation Holes for Spherically Symmetric Atoms
Lin Hou, Tom J. P. Irons, Yanyong Wang, James W. Furness, Andrew M. Teale, Jianwei Sun (2024). Ab Initio Calculation of Coupling-Constant Averaged Exchange–Correlation Holes for Spherically Symmetric Atoms. , 128(39), DOI: https://doi.org/10.1021/acs.jpca.4c02717.
Article51 days agoCoupling-Constant Averaged Exchange-Correlation Hole for He, Li, Be, N, Ne Atoms from CCSD
Lin Hou, Tom J. P. Irons, Yanyong Wang, James W. Furness, Andrew M. Teale, Jianwei Sun (2024). Coupling-Constant Averaged Exchange-Correlation Hole for He, Li, Be, N, Ne Atoms from CCSD. , DOI: https://doi.org/10.48550/arxiv.2403.17424.
Preprint51 days ago