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The low‐lying valence excited states and Rydberg states of the radical species from the ring‐opening reactions in pyrolysis of furan biofuels have been determined by extensive density functional theory and sophisticated wave function theory calculations. The radicals 1‐C4H5O‐2, 2‐furylCH2, and 4‐C6H7O with the delocalized π‐type single electron are predicted to be most stable among the reactive species...
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