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The last 5 uploaded publications
Density-related properties from self-interaction corrected density functional theory calculations
Kushantha P. K. Withanage, Puskar Bhattarai, Juan E. Peralta, Rajendra R. Zope, Tunna Baruah, John P Perdew, Koblar Alan Jackson (2021). Density-related properties from self-interaction corrected density functional theory calculations. , 154(2), DOI: https://doi.org/10.1063/5.0034545.
Article48 days agoEnhancing the accuracy of interior-scaled Perdew-Zunger self-interaction correction
Puskar Bhattarai, Biswajit Santra, Kamal Wagle, Yoh Yamamoto, Rajendra R. Zope, Koblar Jackson, John P Perdew (2021). Enhancing the accuracy of interior-scaled Perdew-Zunger self-interaction correction.
Article48 days agoScaling down the Perdew-Zunger self-interaction correction to the first three rungs of the ladder of density functional approximations
Biswajit Santra, Puskar Bhattarai, Kamal Wagle, Chandra Shahi, Yoh Yamamoto, Selim Romero, Rajendra R. Zope, Juan E. Peralta, Koblar Jackson, John P Perdew (2021). Scaling down the Perdew-Zunger self-interaction correction to the first three rungs of the ladder of density functional approximations.
Article48 days agoScaling down the Perdew-Zunger self-interaction correction to the first three rungs of the ladder of density functional approximations
Biswajit Santra, Puskar Bhattarai, Kamal Wagle, Chandra Shahi, Yoh Yamamoto, Selim Romero, Rajendra R. Zope, Juan E. Peralta, Koblar Jackson, John P Perdew (2021). Scaling down the Perdew-Zunger self-interaction correction to the first three rungs of the ladder of density functional approximations.
Article48 days agoSimple hydrogenic estimates for the exchange and correlation energies of\n atoms and atomic ions, with implications for density functional theory
Aaron D. Kaplan, Biswajit Santra, Puskar Bhattarai, Kamal C. Wagle, Shah Tanvir ur Rahman Chowdhury, Pradeep Bhetwal, Jie Yu, Hong Tang, Kieron Burke, Mel Levy, John P Perdew (2020). Simple hydrogenic estimates for the exchange and correlation energies of\n atoms and atomic ions, with implications for density functional theory. , DOI: https://doi.org/10.48550/arxiv.2007.01917.
Preprint48 days ago