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Intermediates in the hydrogenation of benzene to cyclohexene on Pt(1 1 1) and Pd(1 1 1): A comparison from DFT calculations

✍ Scribed by C. Morin; D. Simon; P. Sautet

No coin nor oath required. For personal study only.

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Intermediates in the hydrogenation of benzene to cyclohexene on Pt(1&#xa0;1&#xa0;1) and Pd(1&#xa0;1&#xa0;1): A comparison from DFT calculations