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Physical Review Letters
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December 30, 2017
Hartree and Exchange in Ensemble Density Functional Theory: Avoiding the Nonuniqueness Disaster
Tim Gould, Stefano Pittalis
Physical Review Letters
|
July 23, 2021
Ensemble Reduced Density Matrix Functional Theory for Excited States and Hierarchical Generalization of Pauli's Exclusion Principle
Christian Schilling, Stefano Pittalis
Physical Review Letters
|
August 7, 2019
Density-Driven Correlations in Many-Electron Ensembles: Theory and Application for Excited States
Tim Gould, Stefano Pittalis
Physical Review Letters
|
December 18, 2020
Ensemble Density Functional Theory: Insight from the Fluctuation-Dissipation Theorem
Tim Gould, Gianluca Stefanucci, Stefano Pittalis
The Journal of Chemical Physics
|
March 3, 2026
Publisher's Note: "'Ensemblization' of density functional theory" [J. Chem. Phys. 164, 040901 (2026)]
Tim Gould, Leeor Kronik, Stefano Pittalis
The Journal of Chemical Physics
|
May 10, 2018
Charge transfer excitations from exact and approximate ensemble Kohn-Sham theory
Tim Gould, Leeor Kronik, Stefano Pittalis
The Journal of Chemical Physics
|
January 30, 2026
"Ensemblization" of density functional theory
Tim Gould, Leeor Kronik, Stefano Pittalis
The Journal of Chemical Physics
|
August 8, 2016
Locality of correlation in density functional theory
Kieron Burke, Antonio Cancio, Tim Gould, et al.
The Journal of Chemical Physics
|
October 17, 2015
Modeling solvation effects in real-space and real-time within density functional approaches
Alain Delgado, Stefano Corni, Stefano Pittalis, et al.
Physical Review Letters
|
January 26, 2026
Physical Spin Torques from Exactly Constrained Exchange-Correlation Torques
Jacques K Desmarais, Kamel Bencheikh, Giovanni Vignale, et al.
Page
of 3
Search research articles
Search
Showing results (1-10 of 22) with videos related to
Sort By:
Page
of 3
Physical Review Letters
|
December 30, 2017
Hartree and Exchange in Ensemble Density Functional Theory: Avoiding the Nonuniqueness Disaster
Tim Gould, Stefano Pittalis
Physical Review Letters
|
July 23, 2021
Ensemble Reduced Density Matrix Functional Theory for Excited States and Hierarchical Generalization of Pauli's Exclusion Principle
Christian Schilling, Stefano Pittalis
Physical Review Letters
|
August 7, 2019
Density-Driven Correlations in Many-Electron Ensembles: Theory and Application for Excited States
Tim Gould, Stefano Pittalis
Physical Review Letters
|
December 18, 2020
Ensemble Density Functional Theory: Insight from the Fluctuation-Dissipation Theorem
Tim Gould, Gianluca Stefanucci, Stefano Pittalis
The Journal of Chemical Physics
|
March 3, 2026
Publisher's Note: "'Ensemblization' of density functional theory" [J. Chem. Phys. 164, 040901 (2026)]
Tim Gould, Leeor Kronik, Stefano Pittalis
The Journal of Chemical Physics
|
May 10, 2018
Charge transfer excitations from exact and approximate ensemble Kohn-Sham theory
Tim Gould, Leeor Kronik, Stefano Pittalis
The Journal of Chemical Physics
|
January 30, 2026
"Ensemblization" of density functional theory
Tim Gould, Leeor Kronik, Stefano Pittalis
The Journal of Chemical Physics
|
August 8, 2016
Locality of correlation in density functional theory
Kieron Burke, Antonio Cancio, Tim Gould, et al.
The Journal of Chemical Physics
|
October 17, 2015
Modeling solvation effects in real-space and real-time within density functional approaches
Alain Delgado, Stefano Corni, Stefano Pittalis, et al.
Physical Review Letters
|
January 26, 2026
Physical Spin Torques from Exactly Constrained Exchange-Correlation Torques
Jacques K Desmarais, Kamel Bencheikh, Giovanni Vignale, et al.
Page
of 3