FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2023853825> ?p ?o ?g. }

• W2023853825 abstract "Some time ago, it has been observed that vibrationally highly excited $text{NO}(v)$ molecules (with typical vibrational quantum numbers $vensuremath{approx}15$) lose substantial amounts of vibrational energy when scattering off a Au(111) surface [H. Huang, C. Rettner, D. Auerbach, and A. Wodtke, Science 290, 111 (2000)]. This has been interpreted as a sign for the breakdown of the Born-Oppenheimer approximation due to vibration-electron coupling. It has been argued that this process cannot be understood on the basis of single-quantum transitions which are typical for ``electronic friction'' models based on a perturbative treatment of weak vibration-electron couplings. Rather, multiple-quanta transitions characteristic for strong nonadiabatic effects are needed according to recent classical surface hopping calculations involving multiple potential-energy surfaces and model Hamiltonians [N. Shenvi, S. Roy, and J. C. Tully, Science 326, 829 (2009)]. Here we address the importance and magnitude of electronic friction for $text{NO}@text{Au}(111)$ by using fully quantum-mechanical, parameter-free first-principles theories in reduced dimensions. Periodic density-functional theory calculations are performed to obtain a ground-state potential-energy surface along the desorption and NO-vibration coordinates, and coordinate-resolved, finite NO vibrational lifetimes due to vibration-electron coupling. Using this input, the scattering event is modeled by open-system density-matrix theory in the frame of the coupled-channel-density-matrix method, which allows for the inclusion of energy relaxation of the scattering NO molecules. It is found that within this model at least, electronic friction accounts for the observed vibrational deactivation of NO scattering from gold." @default.
• W2023853825 created "2016-06-24" @default.
• W2023853825 creator A5036316474 @default.
• W2023853825 creator A5061906414 @default.
• W2023853825 date "2010-08-05" @default.
• W2023853825 modified "2023-09-26" @default.
• W2023853825 title "Role of electronic friction during the scattering of vibrationally excited nitric oxide molecules from Au(111)" @default.
• W2023853825 cites W1964137017 @default.
• W2023853825 cites W1967494078 @default.
• W2023853825 cites W1968131121 @default.
• W2023853825 cites W1977046005 @default.
• W2023853825 cites W1978383896 @default.
• W2023853825 cites W1979544533 @default.
• W2023853825 cites W1988581236 @default.
• W2023853825 cites W1995589262 @default.
• W2023853825 cites W1996107502 @default.
• W2023853825 cites W1996300524 @default.
• W2023853825 cites W1996303459 @default.
• W2023853825 cites W2001293558 @default.
• W2023853825 cites W2001743460 @default.
• W2023853825 cites W2002724440 @default.
• W2023853825 cites W2006163095 @default.
• W2023853825 cites W2010533668 @default.
• W2023853825 cites W2012985991 @default.
• W2023853825 cites W2013074928 @default.
• W2023853825 cites W2015683881 @default.
• W2023853825 cites W2020646862 @default.
• W2023853825 cites W2029446657 @default.
• W2023853825 cites W2029567090 @default.
• W2023853825 cites W2031316117 @default.
• W2023853825 cites W2036113194 @default.
• W2023853825 cites W2039254503 @default.
• W2023853825 cites W2040307467 @default.
• W2023853825 cites W2040658630 @default.
• W2023853825 cites W2043695984 @default.
• W2023853825 cites W2049079467 @default.
• W2023853825 cites W2056856829 @default.
• W2023853825 cites W2057587289 @default.
• W2023853825 cites W2060110919 @default.
• W2023853825 cites W2061002010 @default.
• W2023853825 cites W2067718337 @default.
• W2023853825 cites W2070856307 @default.
• W2023853825 cites W2072975013 @default.
• W2023853825 cites W2079770710 @default.
• W2023853825 cites W2083222334 @default.
• W2023853825 cites W2085207026 @default.
• W2023853825 cites W2086776282 @default.
• W2023853825 cites W2087070363 @default.
• W2023853825 cites W2090468195 @default.
• W2023853825 cites W2090491132 @default.
• W2023853825 cites W2094617455 @default.
• W2023853825 cites W2150084070 @default.
• W2023853825 cites W2151752974 @default.
• W2023853825 cites W2164142691 @default.
• W2023853825 cites W2230728100 @default.
• W2023853825 cites W3104153939 @default.
• W2023853825 cites W3105261196 @default.
• W2023853825 doi "https://doi.org/10.1103/physrevb.82.075404" @default.
• W2023853825 hasPublicationYear "2010" @default.
• W2023853825 type Work @default.
• W2023853825 sameAs 2023853825 @default.
• W2023853825 citedByCount "67" @default.
• W2023853825 countsByYear W20238538252012 @default.
• W2023853825 countsByYear W20238538252013 @default.
• W2023853825 countsByYear W20238538252014 @default.
• W2023853825 countsByYear W20238538252015 @default.
• W2023853825 countsByYear W20238538252016 @default.
• W2023853825 countsByYear W20238538252017 @default.
• W2023853825 countsByYear W20238538252018 @default.
• W2023853825 countsByYear W20238538252019 @default.
• W2023853825 countsByYear W20238538252020 @default.
• W2023853825 countsByYear W20238538252021 @default.
• W2023853825 countsByYear W20238538252022 @default.
• W2023853825 countsByYear W20238538252023 @default.
• W2023853825 crossrefType "journal-article" @default.
• W2023853825 hasAuthorship W2023853825A5036316474 @default.
• W2023853825 hasAuthorship W2023853825A5061906414 @default.
• W2023853825 hasConcept C120665830 @default.
• W2023853825 hasConcept C121332964 @default.
• W2023853825 hasConcept C178790620 @default.
• W2023853825 hasConcept C181500209 @default.
• W2023853825 hasConcept C184779094 @default.
• W2023853825 hasConcept C185592680 @default.
• W2023853825 hasConcept C191486275 @default.
• W2023853825 hasConcept C192562407 @default.
• W2023853825 hasConcept C32909587 @default.
• W2023853825 hasConcept C41999313 @default.
• W2023853825 hasConcept C519581460 @default.
• W2023853825 hasConcept C62520636 @default.
• W2023853825 hasConceptScore W2023853825C120665830 @default.
• W2023853825 hasConceptScore W2023853825C121332964 @default.
• W2023853825 hasConceptScore W2023853825C178790620 @default.
• W2023853825 hasConceptScore W2023853825C181500209 @default.
• W2023853825 hasConceptScore W2023853825C184779094 @default.
• W2023853825 hasConceptScore W2023853825C185592680 @default.
• W2023853825 hasConceptScore W2023853825C191486275 @default.
• W2023853825 hasConceptScore W2023853825C192562407 @default.
• W2023853825 hasConceptScore W2023853825C32909587 @default.
• W2023853825 hasConceptScore W2023853825C41999313 @default.
• W2023853825 hasConceptScore W2023853825C519581460 @default.

• next