Hybrid density functional studies of a b
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O'malley, Patrick J.
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Article
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1999
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John Wiley and Sons
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English
β 208 KB
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Hybrid density functional calculations are performed on models of the bacteriopheophytin a molecule, which acts as an electron acceptor in the initial electron transfer events of bacterial photosynthesis. The geometry of the neutral and one-electron reduced free radical form are calculated. Little v