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The last 5 uploaded publications
Reducing Self-Interaction Error in Transition-Metal Oxides with Different Exact-Exchange Fractions for Energy and Density
Harshan Reddy Gopidi, Ruiqi Zhang, Yanyong Wang, A. K. Patra, Jianwei Sun, Adrienn Ruzsinszky, John P Perdew, Pieremanuele Canepa (2025). Reducing Self-Interaction Error in Transition-Metal Oxides with Different Exact-Exchange Fractions for Energy and Density. , DOI: https://doi.org/10.48550/arxiv.2506.20635.
Preprint25 days agoProperties of real metallic surfaces: Effects of density functional semilocality and van der Waals nonlocality
A. K. Patra, Jefferson E. Bates, Jianwei Sun, John P Perdew (2017). Properties of real metallic surfaces: Effects of density functional semilocality and van der Waals nonlocality. , 114(44), DOI: https://doi.org/10.1073/pnas.1713320114.
Article25 days agoImproved metallic surface properties using a new van der Waals density functional
A. K. Patra, Jianwei Sun, Jefferson E. Bates, John P Perdew (2017). Improved metallic surface properties using a new van der Waals density functional. , 2017
Article25 days agoComparative first-principles study of clean-surface properties of metals
A. K. Patra, Jianwei Sun, John P Perdew (2016). Comparative first-principles study of clean-surface properties of metals. , 2016, DOI: https://doi.org/10.13140/rg.2.2.35244.67203.
Article25 days agoProperties of real metallic surfaces: Effects of density functional semilocality and van der Waals nonlocality
A. K. Patra, Jefferson E. Bates, Jianwei Sun, John P Perdew (2017). Properties of real metallic surfaces: Effects of density functional semilocality and van der Waals nonlocality. , DOI: https://doi.org/10.48550/arxiv.1702.08515.
Preprint25 days ago