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- W2172905979 abstract "State‐of‐the‐art in the area of quantum‐chemical modeling of electron transfer (ET) processes at metal electrode/electrolyte solution interfaces is reviewed. Emphasis is put on key quantities which control the ET rate (activation energy, transmission coefficient, and work terms). Orbital overlap effect in electrocatalysis is thoroughly discussed. The advantages and drawbacks of cluster and periodical slab models for a metal electrode when describing redox processes are analyzed as well. It is stressed that reliable quantitative estimations of the rate constants of interfacial charge transfer reactions are hardly possible, while predictions of qualitatively interesting effects are more valuable. © 2015 Wiley Periodicals, Inc." @default.
- W2172905979 created "2016-06-24" @default.
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- W2172905979 date "2015-11-11" @default.
- W2172905979 modified "2023-10-10" @default.
- W2172905979 title "Modeling of electron transfer across electrochemical interfaces: State-of-the art and challenges for quantum and computational chemistry" @default.
- W2172905979 cites W1502822804 @default.
- W2172905979 cites W1963706294 @default.
- W2172905979 cites W1966962631 @default.
- W2172905979 cites W1967142014 @default.
- W2172905979 cites W1969439984 @default.
- W2172905979 cites W1971175443 @default.
- W2172905979 cites W1971472669 @default.
- W2172905979 cites W1974974274 @default.
- W2172905979 cites W1976604900 @default.
- W2172905979 cites W1977982081 @default.
- W2172905979 cites W1979186401 @default.
- W2172905979 cites W1981255317 @default.
- W2172905979 cites W1981295027 @default.
- W2172905979 cites W1982665963 @default.
- W2172905979 cites W1983110361 @default.
- W2172905979 cites W1986253075 @default.
- W2172905979 cites W1989583783 @default.
- W2172905979 cites W1990556894 @default.
- W2172905979 cites W1990816632 @default.
- W2172905979 cites W1990856386 @default.
- W2172905979 cites W1991092271 @default.
- W2172905979 cites W1991178300 @default.
- W2172905979 cites W1992474064 @default.
- W2172905979 cites W1992693630 @default.
- W2172905979 cites W1994471850 @default.
- W2172905979 cites W1997975701 @default.
- W2172905979 cites W1997984526 @default.
- W2172905979 cites W2000997657 @default.
- W2172905979 cites W2001270915 @default.
- W2172905979 cites W2001585468 @default.
- W2172905979 cites W2002518244 @default.
- W2172905979 cites W2003923184 @default.
- W2172905979 cites W2004510691 @default.
- W2172905979 cites W2006526472 @default.
- W2172905979 cites W2006677739 @default.
- W2172905979 cites W2007252486 @default.
- W2172905979 cites W2008631597 @default.
- W2172905979 cites W2008747343 @default.
- W2172905979 cites W2008778198 @default.
- W2172905979 cites W2010371268 @default.
- W2172905979 cites W2010540843 @default.
- W2172905979 cites W2013001244 @default.
- W2172905979 cites W2013229549 @default.
- W2172905979 cites W2013408872 @default.
- W2172905979 cites W2013998255 @default.
- W2172905979 cites W2014189773 @default.
- W2172905979 cites W2014805454 @default.
- W2172905979 cites W2015570264 @default.
- W2172905979 cites W2017691505 @default.
- W2172905979 cites W2018201939 @default.
- W2172905979 cites W2021641215 @default.
- W2172905979 cites W2022022904 @default.
- W2172905979 cites W2022136916 @default.
- W2172905979 cites W2023036648 @default.
- W2172905979 cites W2023522894 @default.
- W2172905979 cites W2024224624 @default.
- W2172905979 cites W2031332159 @default.
- W2172905979 cites W2031366708 @default.
- W2172905979 cites W2032171922 @default.
- W2172905979 cites W2035401070 @default.
- W2172905979 cites W2035986398 @default.
- W2172905979 cites W2042977182 @default.
- W2172905979 cites W2043962234 @default.
- W2172905979 cites W2044098859 @default.
- W2172905979 cites W2044106894 @default.
- W2172905979 cites W2044180935 @default.
- W2172905979 cites W2045517877 @default.
- W2172905979 cites W2045549415 @default.
- W2172905979 cites W2056206737 @default.
- W2172905979 cites W2059632004 @default.
- W2172905979 cites W2060823349 @default.
- W2172905979 cites W2067897399 @default.
- W2172905979 cites W2069853687 @default.
- W2172905979 cites W2070854715 @default.
- W2172905979 cites W2071059609 @default.
- W2172905979 cites W2072648023 @default.
- W2172905979 cites W2073006389 @default.
- W2172905979 cites W2074527904 @default.
- W2172905979 cites W2076853423 @default.
- W2172905979 cites W2078234571 @default.
- W2172905979 cites W2079032548 @default.
- W2172905979 cites W2082487597 @default.
- W2172905979 cites W2086310984 @default.
- W2172905979 cites W2091105378 @default.
- W2172905979 cites W2091908909 @default.
- W2172905979 cites W2098747335 @default.
- W2172905979 cites W2100887556 @default.
- W2172905979 cites W2113274671 @default.
- W2172905979 cites W2119916225 @default.