Overview of Theoretical and Computational Methods Applied to the Oxygen–Organic Molecule Photosystem

Martin J. Paterson; Ove Christiansen; Frank Jensen; Peter R. Ogilby

doi:10.1562/2006-03-17-IR-851

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Martin J. Paterson,¹ Ove Christiansen,¹ Frank Jensen,² Peter R. Ogilby^1,*

¹aDepartment of Chemistry, University of Aarhus, Århus, DK-8000, Denmark
²bDepartment of Chemistry, University of Southern Denmark, Odense, DK-5230, Denmark

^**Corresponding author progilby@chem.au.dk (Peter R. Ogilby)

Abstract

The challenges of using modern theoretical and computational tools to model the unique features of the oxygen–organic molecule photosystem are discussed from a historical and pedagogical perspective. This review is written for the novice, but the problems formulated should stimulate the expert.

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Martin J. Paterson, Ove Christiansen, Frank Jensen, and Peter R. Ogilby "Overview of Theoretical and Computational Methods Applied to the Oxygen–Organic Molecule Photosystem," Photochemistry and Photobiology 82(5), 1136-1160, (1 September 2006). https://doi.org/10.1562/2006-03-17-IR-851

Received: 17 March 2006; Accepted: 24 April 2006; Published: 1 September 2006

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