Complex Fermi–Löwdin orbital self-interaction correction von Withanage, Kushantha P. K., Jackson, Koblar A., Pederson, Mark R.

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Symmetry breaking and self-interaction correction in the chromium atom and dimer von Maniar, Rohan, Withanage, Kushantha P. K., Shahi, Chandra, Kaplan, Aaron D., Perdew, John P., Pederson, Mark R.

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The effect of self-interaction error on electrostatic dipoles calculated using density functional theory von Johnson, Alexander I., Withanage, Kushantha P. K., Sharkas, Kamal, Yamamoto, Yoh, Baruah, Tunna, Zope, Rajendra R., Peralta, Juan E., Jackson, Koblar A.

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Downward quantum learning from element 118: Automated generation of Fermi–Löwdin orbitals for all atoms von Pederson, Mark R., Johnson, Alexander I., Withanage, Kushantha P. K., Dolma, Sherab, Flores, Gustavo Bravo, Hooshmand, Zahra, Khandal, Kusal, Lasode, Peter O., Baruah, Tunna, Jackson, Koblar A.

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Use of FLOSIC for understanding anion-solvent interactions von Pederson, Mark R., Withanage, Kushantha P. K., Hooshmand, Zahra, Johnson, Alex I., Baruah, Tunna, Yamamoto, Yoh, Zope, Rajendra R., Kao, Der-You, Shukla, Priyanka B., Johnson, J. Karl, Peralta, Juan E., Jackson, Koblar A.

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Density-related properties from self-interaction corrected density functional theory calculations von Withanage, Kushantha P. K., Bhattarai, Puskar, Peralta, Juan E., Zope, Rajendra R., Baruah, Tunna, Perdew, John P., Jackson, Koblar A.

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Analytic atomic gradients in the fermi‐löwdin orbital self‐interaction correction von Trepte, Kai, Schwalbe, Sebastian, Hahn, Torsten, Kortus, Jens, Kao, Der‐You, Yamamoto, Yoh, Baruah, Tunna, Zope, Rajendra R., Withanage, Kushantha P. K., Peralta, Juan E., Jackson, Koblar A.

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Electronic structure simulations in the cloud computing environment von Bylaska, Eric J., Panyala, Ajay, Bauman, Nicholas P., Peng, Bo, Pathak, Himadri, Mejia-Rodriguez, Daniel, Govind, Niranjan, Williams-Young, David B., Aprà, Edoardo, Bagusetty, Abhishek, Mutlu, Erdal, Jackson, Koblar A., Baruah, Tunna, Yamamoto, Yoh, Pederson, Mark R., Withanage, Kushantha P. K., Pedroza-Montero, Jesús N., Bilbrey, Jenna A., Choudhury, Sutanay, Firoz, Jesun, Herman, Kristina M., Xantheas, Sotiris S., Rigor, Paul, Vila, Fernando D., Rehr, John J., Fung, Mimi, Grofe, Adam, Johnston, Conrad, Baker, Nathan, Kaneko, Ken, Liu, Hongbin, Kowalski, Karol

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Fermi-Löwdin orbital self-interaction correction to magnetic exchange couplings von Joshi, Rajendra P., Trepte, Kai, Withanage, Kushantha P. K., Sharkas, Kamal, Yamamoto, Yoh, Basurto, Luis, Zope, Rajendra R., Baruah, Tunna, Jackson, Koblar A., Peralta, Juan E.

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Shrinking Self-Interaction Errors with the Fermi-Löwdin Orbital Self-Interaction-Corrected Density Functional Approximation von Sharkas, Kamal, Li, Lin, Trepte, Kai, Withanage, Kushantha P K, Joshi, Rajendra P, Zope, Rajendra R, Baruah, Tunna, Johnson, J Karl, Jackson, Koblar A, Peralta, Juan E

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Fermi–Löwdin orbital self-interaction correction of adsorption energies on transition metal ions von Withanage, Kushantha P. K., Sharkas, Kamal, Johnson, J. Karl, Perdew, John P., Peralta, Juan E., Jackson, Koblar A.

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On the Question of the Total Energy in the Fermi-Löwdin Orbital Self-Interaction Correction Method von Withanage, Kushantha P K, Trepte, Kai, Peralta, Juan E, Baruah, Tunna, Zope, Rajendra, Jackson, Koblar A

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Comment: "Additional Insights between Fermi-Löwdin Orbital SIC and the Localization Equation Constraints in SIC-DFT" von Jackson, Koblar Alan, Withanage, Kushantha P K, Peralta, Juan E

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Fermi–Löwdin orbital self-interaction correction of adsorption energies on transition metal ions von Withanage, Kushantha P. K., Sharkas, Kamal, Johnson, J. Karl, Perdew, John P., Peralta, Juan E., Jackson, Koblar A.

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Density-related properties from self-interaction corrected density functional theory calculations von Withanage, Kushantha P. K., Bhattarai, Puskar, Peralta, Juan E., Zope, Rajendra R., Baruah, Tunna, Perdew, John P., Jackson, Koblar A.

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Self-interaction-free electric dipole polarizabilities for atoms and their ions using the Fermi-Löwdin self-interaction correction von Withanage, Kushantha P. K., Akter, Sharmin, Shahi, Chandra, Joshi, Rajendra P., Diaz, Carlos, Yamamoto, Yoh, Zope, Rajendra, Baruah, Tunna, Perdew, John P., Peralta, Juan E., Jackson, Koblar A.

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Noncollinear first-principles studies of the spin-electric coupling in frustrated triangular molecular magnets von Islam, M. F., Withanage, Kushantha P. K., Canali, C. M., Pederson, Mark R.

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On the Question of the Total Energy in the Fermi–Löwdin Orbital Self-Interaction Correction Method von Withanage, Kushantha P. K., Trepte, Kai, Peralta, Juan E., Baruah, Tunna, Zope, Rajendra, Jackson, Koblar A.

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The effect of self-interaction error on electrostatic dipoles calculated using density functional theory von Johnson, Alexander I., Withanage, Kushantha P. K., Sharkas, Kamal, Yamamoto, Yoh, Baruah, Tunna, Zope, Rajendra R., Peralta, Juan E., Jackson, Koblar A.

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Fermi-Löwdin orbital self-interaction correction to magnetic exchangecouplings von Joshi, Rajendra P, Trepte Kai, Withanage Kushantha P K, Sharkas Kamal, Yamamoto Yoh, Basurto Luis, Zope, Rajendra R, Baruah Tunna, Jackson, Koblar A, Peralta, Juan E

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