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The electron localization function and the chemical interpretation of Fermi orbital descriptors in Fermi–Löwdin self-interaction correction calculations
Duyen B. Nguyen, Carlos Cárdenas, Jerónimo Lira, John P Perdew, Koblar Alan Jackson, Juan E. Peralta (2025). The electron localization function and the chemical interpretation of Fermi orbital descriptors in Fermi–Löwdin self-interaction correction calculations. , 162(14), DOI: https://doi.org/10.1063/5.0263003.
Article83 days agoInitial Fermi orbital descriptors for FLOSIC calculations: The quick-FOD method
Duyen B. Nguyen, Mark R. Pederson, John P Perdew, Koblar Alan Jackson, Juan E. Peralta (2021). Initial Fermi orbital descriptors for FLOSIC calculations: The quick-FOD method. , 780, DOI: https://doi.org/10.1016/j.cplett.2021.138952.
Article83 days agoInitial Fermi orbital descriptors for FLOSIC calculations: The quick-FOD method
Duyen B. Nguyen, Mark R. Pederson, John P Perdew, Koblar Alan Jackson, Juan E. Peralta (2021). Initial Fermi orbital descriptors for FLOSIC calculations: The quick-FOD method. , 780, DOI: https://doi.org/10.1016/j.cplett.2021.138952.
Article83 days ago