Matches in SemOpenAlex for { <https://semopenalex.org/work/W2557220528> ?p ?o ?g. }
- W2557220528 endingPage "12614" @default.
- W2557220528 startingPage "12604" @default.
- W2557220528 abstract "We use nonadiabatic mixed quantum/classical molecular dynamics to simulate recent time-resolved photoelectron spectroscopy (TRPES) experiments on the hydrated electron, and compare the results for both a cavity and a noncavity simulation model to experiment. We find that cavity-model hydrated electrons show an “adiabatic” relaxation mechanism, with ground-state cooling that is fast on the time scale of the internal conversion, a feature that is in contrast to the TRPES experiments. A noncavity hydrated electron model, however, displays a “nonadiabatic” relaxation mechanism, with rapid internal conversion followed by slower ground-state cooling, in good qualitative agreement with experiment. We also show that the experimentally observed early time red shift and loss of anisotropy of the excited-state TRPES peak are consistent with hydrated electron models with homogeneously broadened absorption spectra, but not with those with inhomogeneously broadened absorption spectra. Finally, we find that a decreasing photoionization cross section upon cooling causes the excited-state TRPES peak to decay faster than the underlying radiationless relaxation process, so that the experimentally observed 60–75 fs peak decay corresponds to an actual excited-state lifetime of the hydrated electron that is more likely ∼100 fs." @default.
- W2557220528 created "2016-11-30" @default.
- W2557220528 creator A5044054259 @default.
- W2557220528 creator A5055544547 @default.
- W2557220528 date "2016-11-30" @default.
- W2557220528 modified "2023-10-14" @default.
- W2557220528 title "Time-Resolved Photoelectron Spectroscopy of the Hydrated Electron: Comparing Cavity and Noncavity Models to Experiment" @default.
- W2557220528 cites W1560312716 @default.
- W2557220528 cites W1970022823 @default.
- W2557220528 cites W1977741966 @default.
- W2557220528 cites W1979143340 @default.
- W2557220528 cites W1979393322 @default.
- W2557220528 cites W1987327282 @default.
- W2557220528 cites W1988797087 @default.
- W2557220528 cites W1995052921 @default.
- W2557220528 cites W2001773554 @default.
- W2557220528 cites W2003731269 @default.
- W2557220528 cites W2004555235 @default.
- W2557220528 cites W2010227867 @default.
- W2557220528 cites W2010734371 @default.
- W2557220528 cites W2011379164 @default.
- W2557220528 cites W2014063669 @default.
- W2557220528 cites W2016058684 @default.
- W2557220528 cites W2019190773 @default.
- W2557220528 cites W2020786332 @default.
- W2557220528 cites W2022243104 @default.
- W2557220528 cites W2025457777 @default.
- W2557220528 cites W2025504048 @default.
- W2557220528 cites W2029757515 @default.
- W2557220528 cites W2031582657 @default.
- W2557220528 cites W2036488941 @default.
- W2557220528 cites W2036628462 @default.
- W2557220528 cites W2038029283 @default.
- W2557220528 cites W2039407631 @default.
- W2557220528 cites W2041901838 @default.
- W2557220528 cites W2043979193 @default.
- W2557220528 cites W2045913892 @default.
- W2557220528 cites W2049275971 @default.
- W2557220528 cites W2052986749 @default.
- W2557220528 cites W2053631764 @default.
- W2557220528 cites W2059383983 @default.
- W2557220528 cites W2067001445 @default.
- W2557220528 cites W2067970470 @default.
- W2557220528 cites W2068920655 @default.
- W2557220528 cites W2071551596 @default.
- W2557220528 cites W2072522038 @default.
- W2557220528 cites W2072607344 @default.
- W2557220528 cites W2075586555 @default.
- W2557220528 cites W2077704962 @default.
- W2557220528 cites W2083327829 @default.
- W2557220528 cites W2085831702 @default.
- W2557220528 cites W2087937597 @default.
- W2557220528 cites W2089161466 @default.
- W2557220528 cites W2089699052 @default.
- W2557220528 cites W2096622965 @default.
- W2557220528 cites W2105176602 @default.
- W2557220528 cites W2113124936 @default.
- W2557220528 cites W2114112946 @default.
- W2557220528 cites W2115937072 @default.
- W2557220528 cites W2127555412 @default.
- W2557220528 cites W2135218668 @default.
- W2557220528 cites W2139606862 @default.
- W2557220528 cites W2155099467 @default.
- W2557220528 cites W2158689308 @default.
- W2557220528 cites W2313030255 @default.
- W2557220528 cites W2316601509 @default.
- W2557220528 cites W2317980582 @default.
- W2557220528 cites W2318420782 @default.
- W2557220528 cites W2339238784 @default.
- W2557220528 cites W2387919377 @default.
- W2557220528 cites W2413504267 @default.
- W2557220528 cites W2500353591 @default.
- W2557220528 cites W2514193402 @default.
- W2557220528 doi "https://doi.org/10.1021/acs.jpcb.6b07852" @default.
- W2557220528 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/27973828" @default.
- W2557220528 hasPublicationYear "2016" @default.
- W2557220528 type Work @default.
- W2557220528 sameAs 2557220528 @default.
- W2557220528 citedByCount "22" @default.
- W2557220528 countsByYear W25572205282017 @default.
- W2557220528 countsByYear W25572205282018 @default.
- W2557220528 countsByYear W25572205282019 @default.
- W2557220528 countsByYear W25572205282020 @default.
- W2557220528 countsByYear W25572205282021 @default.
- W2557220528 countsByYear W25572205282022 @default.
- W2557220528 countsByYear W25572205282023 @default.
- W2557220528 crossrefType "journal-article" @default.
- W2557220528 hasAuthorship W2557220528A5044054259 @default.
- W2557220528 hasAuthorship W2557220528A5055544547 @default.
- W2557220528 hasConcept C109663097 @default.
- W2557220528 hasConcept C116039458 @default.
- W2557220528 hasConcept C119824511 @default.
- W2557220528 hasConcept C120665830 @default.
- W2557220528 hasConcept C121332964 @default.
- W2557220528 hasConcept C125287762 @default.
- W2557220528 hasConcept C1276947 @default.
- W2557220528 hasConcept C145148216 @default.
- W2557220528 hasConcept C147120987 @default.