Redox Free Energies from Vertical Energy Gaps: Ab Initio Molecular Dynamics Implementation
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Publisher
Springer Berlin Heidelberg
Link
http://link.springer.com/content/pdf/10.1007/3-540-35284-8_18.pdf
Reference55 articles.
1. R. A. Marcus (1956) Theory of oxidation-reduction reactions involving electron transfer.1. J. Chem. Phys. 24, p. 966
2. R. A. Marcus (1960) Theory of oxidation-reduction reactions involving electron transfer.4. A statistical-mechanical basis for treating contributions from solvent, ligands, and inert salt. Discuss. Faraday Soc. 29, p. 21
3. R. A. Marcus (1965) On theory of electron-transfer reactions.6. Unified treatment for homogeneous and electrode reactions. J. Chem. Phys. 43, p. 679
4. R. A. Marcus (1993) Electron-transfer reactions in chemistry – theory and experiment. Rev. Mod. Phys. 65, p. 599
5. A. Warshel (1982) Dynamics of reactions in polar-solvents – semi-classical trajectory studies of electron-transfer and proton-transfer reactions. J. Phys. Chem. 86, p. 2218
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