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Recent theoretical studies of water oxidation in photosystem II
Stockholm University, Faculty of Science, Department of Physics. Stockholm University, Faculty of Science, Department of Biochemistry and Biophysics.
2011 (English)In: Journal of Photochemistry and Photobiology. B: Biology, ISSN 1011-1344, E-ISSN 1873-2682, Vol. 104, no 1-2, 94-99 p.Article, review/survey (Refereed) Published
Abstract [en]

In the present mini-review, computational work over the past decade on water oxidation in photosystem II (PSII) is summarized. The size of the chemical model used for the oxygen evolving complex (OEC) has during this time increased from the initial 20 atoms to the present day 220 atoms. The electronic structure methods used have during the same period only undergone minor improvements. It is concluded that the results have now reached a high level of convergence and the predictions for both the structure of the OEC and the O-O bond formation mechanism are most probably of higher accuracy than presently available from experiments.

Place, publisher, year, edition, pages
2011. Vol. 104, no 1-2, 94-99 p.
Keyword [en]
Water oxidation, Calculations, Oxygen evolving complex
National Category
Physical Sciences
Identifiers
URN: urn:nbn:se:su:diva-66967DOI: 10.1016/j.jphotobiol.2011.01.014ISI: 000292066000010OAI: oai:DiVA.org:su-66967DiVA: diva2:470237
Note
authorCount :1Available from: 2011-12-28 Created: 2011-12-22 Last updated: 2017-12-08Bibliographically approved

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Siegbahn, Per E. M.
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