Article Dans Une Revue Journal of Physical Chemistry A Année : 2025

Test of the Orbital-Based LI3 Index as a Predictor of the Height of the 3 MLCT → 3 MC Transition-State Barrier for [Ru(N ∧ N) 3 ] 2+ Polypyridine Complexes in CH 3 CN

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hal-04976957 , version 1 (04-03-2025)

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Ala Aldin M. H. M. Darghouth, Denis Magero, Mark Casida. Test of the Orbital-Based LI3 Index as a Predictor of the Height of the 3 MLCT → 3 MC Transition-State Barrier for [Ru(N ∧ N) 3 ] 2+ Polypyridine Complexes in CH 3 CN. Journal of Physical Chemistry A, 2025, 129 (8), pp.1960-1971. ⟨10.1021/acs.jpca.4c07424⟩. ⟨hal-04976957⟩
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