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The last 5 uploaded publications
Perdew-Zunger Self-Interaction Correction in Neutral, Protonated, and Deprotonated Water Clusters
Kamal Wagle, Biswajit Santra, Kamal Sharkas, Sharmin Akter, Rajendra R. Zope, Tunna Baruah, Koblar Alan Jackson, Juan E. Peralta, John P Perdew (2020). Perdew-Zunger Self-Interaction Correction in Neutral, Protonated, and Deprotonated Water Clusters.
Article37 days agoPerdew-Zunger Self-Interaction Correction in Neutral, Protonated, and Deprotonated Water Clusters
Kamal Wagle, Biswajit Santra, Kamal Sharkas, Sharmin Akter, Rajendra R. Zope, Tunna Baruah, Koblar Alan Jackson, Juan E. Peralta, John P Perdew (2020). Perdew-Zunger Self-Interaction Correction in Neutral, Protonated, and Deprotonated Water Clusters.
Article37 days agoSelf-interaction error overbinds water clusters but cancels in structural energy differences
Kamal Sharkas, Kamal Wagle, Biswajit Santra, Sharmin Akter, Rajendra R. Zope, Tunna Baruah, Koblar Alan Jackson, John P Perdew, Juan E. Peralta (2020). Self-interaction error overbinds water clusters but cancels in structural energy differences. , 117(21), DOI: https://doi.org/10.1073/pnas.1921258117.
Article37 days agoSelf-interaction corrected dipole polarizabilites of free atoms and their ions
Kushantha P. K. Withanage, Sharmin Akter, Chandra Shahi, Tunna Baruah, Rajendra R. Zope, John P Perdew, Juan E. Peralta, Koblar Alan Jackson (2019). Self-interaction corrected dipole polarizabilites of free atoms and their ions. , 2019
Article37 days agoSelf-interaction corrected dipole polarizabilites of free atoms and their ions
Kushantha P. K. Withanage, Sharmin Akter, Chandra Shahi, Tunna Baruah, Rajendra R. Zope, John P Perdew, Juan E. Peralta, Koblar Alan Jackson (2019). Self-interaction corrected dipole polarizabilites of free atoms and their ions. , 2019
Article37 days ago