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TDDFT Assessment of Functionals for Optical 0–0 Transitions in Small Radicals

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https://hal.inria.fr/hal-01673983
Contributor : Abdulrahman Allouche <>
Submitted on : Monday, January 1, 2018 - 5:50:31 PM
Last modification on : Thursday, October 15, 2020 - 8:54:03 AM

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Loïc Barnes, Saleh Abdul-Al, Abdul-Rahman Allouche. TDDFT Assessment of Functionals for Optical 0–0 Transitions in Small Radicals. Journal of Physical Chemistry A, American Chemical Society, 2014, 118 (46), pp.11033 - 11046. ⟨10.1021/jp5078032⟩. ⟨hal-01673983⟩

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