An Energetic Comparison of Different Models for the Oxygen Evolving Complex of Photosystem II

The computed total energy from a cluster model DFT calculation is used to discriminate between different suggested models for the oxygen evolving complex of photosystem II. The comparison between different structures rules out several suggestions. Only one suggested structure remains.

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Veröffentlicht in:Journal of the American Chemical Society 2009-12, Vol.131 (51), p.18238-18239
1. Verfasser: Siegbahn, Per E. M
Format: Artikel
Sprache:eng
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Zusammenfassung:The computed total energy from a cluster model DFT calculation is used to discriminate between different suggested models for the oxygen evolving complex of photosystem II. The comparison between different structures rules out several suggestions. Only one suggested structure remains.
ISSN:0002-7863
1520-5126
1520-5126
DOI:10.1021/ja908712a