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Influence of Triplet Instabilities in TDDFT (2011)
Journal Article
Peach, M., Williamson, M., & Tozer, D. (2011). Influence of Triplet Instabilities in TDDFT. Journal of Chemical Theory and Computation, 7(11), 3578-3585. https://doi.org/10.1021/ct200651r

Singlet and triplet vertical excitation energies from time-dependent density functional theory (TDDFT) can be affected in different ways by the inclusion of exact exchange in hybrid or Coulomb-attenuated/range-separated exchange–correlation functiona... Read More about Influence of Triplet Instabilities in TDDFT.

Dispersion, static correlation, and delocalisation errors in density functional theory: An electrostatic theorem perspective (2011)
Journal Article
Dwyer, A., & Tozer, D. (2011). Dispersion, static correlation, and delocalisation errors in density functional theory: An electrostatic theorem perspective. The Journal of Chemical Physics, 135(16), Article 164110. https://doi.org/10.1063/1.3653980

Dispersion, static correlation, and delocalisation errors in density functional theory are considered from the unconventional perspective of the force on a nucleus in a stretched diatomic molecule. The electrostatic theorem of Feynman is used to rela... Read More about Dispersion, static correlation, and delocalisation errors in density functional theory: An electrostatic theorem perspective.