Trans cis isomerization in long linear polyenes as beta-carotene models: a comparative CAS-PT2 and DFT study

Author: Bernardi Fernando   Garavelli Marco   Olivucci Massimo  

Publisher: Taylor & Francis Ltd

ISSN: 1362-3028

Source: Molecular Physics, Vol.92, Iss.3, 1997-10, pp. : 359-364

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Abstract