Density Functional Study on the Reaction Mechanism of Proton Transfer in 
2-Pyridone: Effect of Hydration and Self-Association

Fu, A.; Li, H.; Du, D.; Zhou, Z.

doi:10.1021/jp0453764

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Density Functional Study on the Reaction Mechanism of Proton Transfer in 2-Pyridone: Effect of Hydration and Self-Association

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Fu, A.
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;

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Li, H.
Research Department Schüth, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Schüth, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Schüth, Max-Planck-Institut für Kohlenforschung, Max Planck Society;

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Fu, A., Li, H., Du, D., & Zhou, Z. (2005). Density Functional Study on the Reaction Mechanism of Proton Transfer in 2-Pyridone: Effect of Hydration and Self-Association. Journal of Physical Chemistry A, 109, 1468-1477. doi:10.1021/jp0453764.

Cite as: https://hdl.handle.net/11858/00-001M-0000-000F-9651-E

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