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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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Per E. M. Siegbahn (Fri,) studied this question.
synapsesocial.com/papers/6a221b2e3081c2f8f8e241d1 — DOI: https://doi.org/10.1021/ja908712a
Per E. M. Siegbahn
Goddard Institute for Space Studies
Journal of the American Chemical Society
Stockholm University
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