Matches in SemOpenAlex for { <https://semopenalex.org/work/W3025837587> ?p ?o ?g. }
- W3025837587 abstract "The Marcus equation for the rate of an electron-transfer reaction can be generalized to cover larger electronic-interaction matrix elements, irregular free-energy surfaces, and coupling to multiple vibrational modes and to recognize the different effects of vibrational relaxations and pure dephasing. Almost all the information needed to calculate the rate constant can be obtained from a quantum-classical molecular dynamics simulation of the system in the reactant state. Because the final expression for the rate constant does not depend on the reorganization energy, it is insensitive to slow relaxations that follow the reaction." @default.
- W3025837587 created "2020-05-21" @default.
- W3025837587 creator A5007975306 @default.
- W3025837587 date "2020-05-12" @default.
- W3025837587 modified "2023-09-23" @default.
- W3025837587 title "Generalizing the Marcus equation" @default.
- W3025837587 cites W120973802 @default.
- W3025837587 cites W1966624508 @default.
- W3025837587 cites W1967427050 @default.
- W3025837587 cites W1968719859 @default.
- W3025837587 cites W1968888257 @default.
- W3025837587 cites W1969211920 @default.
- W3025837587 cites W1974167806 @default.
- W3025837587 cites W1975874144 @default.
- W3025837587 cites W1976735964 @default.
- W3025837587 cites W1978025944 @default.
- W3025837587 cites W1980169574 @default.
- W3025837587 cites W1981765943 @default.
- W3025837587 cites W1982680156 @default.
- W3025837587 cites W1985889445 @default.
- W3025837587 cites W1989384815 @default.
- W3025837587 cites W1992021800 @default.
- W3025837587 cites W1993439357 @default.
- W3025837587 cites W1995842593 @default.
- W3025837587 cites W2001270915 @default.
- W3025837587 cites W2008468260 @default.
- W3025837587 cites W2008631597 @default.
- W3025837587 cites W2011245107 @default.
- W3025837587 cites W2013659289 @default.
- W3025837587 cites W2014135779 @default.
- W3025837587 cites W2016090732 @default.
- W3025837587 cites W2018201939 @default.
- W3025837587 cites W2027142213 @default.
- W3025837587 cites W2030103626 @default.
- W3025837587 cites W2031871925 @default.
- W3025837587 cites W2034752870 @default.
- W3025837587 cites W2043362560 @default.
- W3025837587 cites W2043402765 @default.
- W3025837587 cites W2046133238 @default.
- W3025837587 cites W2048179370 @default.
- W3025837587 cites W2048963291 @default.
- W3025837587 cites W2050193665 @default.
- W3025837587 cites W2053672057 @default.
- W3025837587 cites W2055275145 @default.
- W3025837587 cites W2060492750 @default.
- W3025837587 cites W2064709291 @default.
- W3025837587 cites W2065347736 @default.
- W3025837587 cites W2065701683 @default.
- W3025837587 cites W2065797698 @default.
- W3025837587 cites W2076004384 @default.
- W3025837587 cites W2076602648 @default.
- W3025837587 cites W2076744620 @default.
- W3025837587 cites W2077550991 @default.
- W3025837587 cites W2083088477 @default.
- W3025837587 cites W2086341479 @default.
- W3025837587 cites W2086449509 @default.
- W3025837587 cites W2086864852 @default.
- W3025837587 cites W2087047168 @default.
- W3025837587 cites W2091237955 @default.
- W3025837587 cites W2093701962 @default.
- W3025837587 cites W2094820352 @default.
- W3025837587 cites W2123361937 @default.
- W3025837587 cites W2127341056 @default.
- W3025837587 cites W2137902859 @default.
- W3025837587 cites W2144690980 @default.
- W3025837587 cites W2144757830 @default.
- W3025837587 cites W2312255505 @default.
- W3025837587 cites W2320454304 @default.
- W3025837587 cites W2323999962 @default.
- W3025837587 cites W2333968681 @default.
- W3025837587 cites W2513213608 @default.
- W3025837587 cites W2535129907 @default.
- W3025837587 cites W2746718465 @default.
- W3025837587 cites W2753926558 @default.
- W3025837587 cites W2766085759 @default.
- W3025837587 cites W2793787285 @default.
- W3025837587 cites W2891770688 @default.
- W3025837587 cites W2949753462 @default.
- W3025837587 cites W3021518424 @default.
- W3025837587 cites W4251836420 @default.
- W3025837587 doi "https://doi.org/10.1063/5.0007569" @default.
- W3025837587 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/32414254" @default.
- W3025837587 hasPublicationYear "2020" @default.
- W3025837587 type Work @default.
- W3025837587 sameAs 3025837587 @default.
- W3025837587 citedByCount "5" @default.
- W3025837587 countsByYear W30258375872020 @default.
- W3025837587 countsByYear W30258375872021 @default.
- W3025837587 countsByYear W30258375872022 @default.
- W3025837587 countsByYear W30258375872023 @default.
- W3025837587 crossrefType "journal-article" @default.
- W3025837587 hasAuthorship W3025837587A5007975306 @default.
- W3025837587 hasConcept C106487976 @default.
- W3025837587 hasConcept C121332964 @default.
- W3025837587 hasConcept C123669783 @default.
- W3025837587 hasConcept C127413603 @default.
- W3025837587 hasConcept C128805008 @default.
- W3025837587 hasConcept C131584629 @default.
- W3025837587 hasConcept C147597530 @default.
- W3025837587 hasConcept C147789679 @default.