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- W2339446211 endingPage "20842" @default.
- W2339446211 startingPage "20833" @default.
- W2339446211 abstract "The ability to simulate surface-enhanced Raman scattering (SERS) is a vital tool in elucidating the chemistry of molecules near the vicinity of plasmonic metal nanoparticles. However, typical methods do not include the dynamics of the molecule(s) of interest and are often limited to a single or few molecules. In this work, we combine molecular dynamics simulations with the dressed-tensor formalism to simulate the SERS spectra of Ag nanoparticles coated with a full monolayer of pyridine molecules. This method allows us to simulate the ensemble-averaged SERS spectra of more realistic large scale systems, while accounting for the organization of molecules in the hotspots. Through these simulations, we find that the preferential binding location and orientation of the molecules, the choice of electrodynamics method, and the inclusion of field gradient effects influence both the enhancement distribution and the spectral signatures. We also show that both the translational and rotational motions of a pyridine molecule near a nanoparticle junction may be effectively tracked through its SERS spectrum." @default.
- W2339446211 created "2016-06-24" @default.
- W2339446211 creator A5033532580 @default.
- W2339446211 creator A5053090797 @default.
- W2339446211 creator A5054729024 @default.
- W2339446211 date "2016-05-02" @default.
- W2339446211 modified "2023-10-18" @default.
- W2339446211 title "Simulating Ensemble-Averaged Surface-Enhanced Raman Scattering" @default.
- W2339446211 cites W1546843241 @default.
- W2339446211 cites W1963860368 @default.
- W2339446211 cites W1967450231 @default.
- W2339446211 cites W1969611322 @default.
- W2339446211 cites W1978464097 @default.
- W2339446211 cites W1979423196 @default.
- W2339446211 cites W1981654685 @default.
- W2339446211 cites W1982179589 @default.
- W2339446211 cites W1996263400 @default.
- W2339446211 cites W1997639940 @default.
- W2339446211 cites W1999041388 @default.
- W2339446211 cites W1999173254 @default.
- W2339446211 cites W2008218010 @default.
- W2339446211 cites W2009120048 @default.
- W2339446211 cites W2009658139 @default.
- W2339446211 cites W2010014537 @default.
- W2339446211 cites W2011994939 @default.
- W2339446211 cites W2013062861 @default.
- W2339446211 cites W2015688756 @default.
- W2339446211 cites W2017324300 @default.
- W2339446211 cites W2018870709 @default.
- W2339446211 cites W2019465613 @default.
- W2339446211 cites W2021308495 @default.
- W2339446211 cites W2025235626 @default.
- W2339446211 cites W2025384338 @default.
- W2339446211 cites W2025475197 @default.
- W2339446211 cites W2026075600 @default.
- W2339446211 cites W2028146845 @default.
- W2339446211 cites W2028907810 @default.
- W2339446211 cites W2030687437 @default.
- W2339446211 cites W2035153845 @default.
- W2339446211 cites W2035227761 @default.
- W2339446211 cites W2040874018 @default.
- W2339446211 cites W2042522703 @default.
- W2339446211 cites W2043044330 @default.
- W2339446211 cites W2043259729 @default.
- W2339446211 cites W2043852629 @default.
- W2339446211 cites W2044024547 @default.
- W2339446211 cites W2044591029 @default.
- W2339446211 cites W2045734636 @default.
- W2339446211 cites W2046785797 @default.
- W2339446211 cites W2048290125 @default.
- W2339446211 cites W2049071460 @default.
- W2339446211 cites W2049759353 @default.
- W2339446211 cites W2063547660 @default.
- W2339446211 cites W2067788767 @default.
- W2339446211 cites W2069015156 @default.
- W2339446211 cites W2069534402 @default.
- W2339446211 cites W2071288513 @default.
- W2339446211 cites W2074473705 @default.
- W2339446211 cites W2079822156 @default.
- W2339446211 cites W2080511631 @default.
- W2339446211 cites W2085320170 @default.
- W2339446211 cites W2086957099 @default.
- W2339446211 cites W2086971829 @default.
- W2339446211 cites W2087076038 @default.
- W2339446211 cites W2087809265 @default.
- W2339446211 cites W2091273808 @default.
- W2339446211 cites W2091779611 @default.
- W2339446211 cites W2092157292 @default.
- W2339446211 cites W2095374362 @default.
- W2339446211 cites W2108446403 @default.
- W2339446211 cites W2115797520 @default.
- W2339446211 cites W2116415775 @default.
- W2339446211 cites W2134304198 @default.
- W2339446211 cites W2137942521 @default.
- W2339446211 cites W2138994977 @default.
- W2339446211 cites W2139002972 @default.
- W2339446211 cites W2141116756 @default.
- W2339446211 cites W2143091352 @default.
- W2339446211 cites W2144762499 @default.
- W2339446211 cites W2147993766 @default.
- W2339446211 cites W2149104021 @default.
- W2339446211 cites W2150345533 @default.
- W2339446211 cites W2153642255 @default.
- W2339446211 cites W2154773020 @default.
- W2339446211 cites W2155462488 @default.
- W2339446211 cites W2159981054 @default.
- W2339446211 cites W2160741150 @default.
- W2339446211 cites W2162246342 @default.
- W2339446211 cites W2166198169 @default.
- W2339446211 cites W2169945685 @default.
- W2339446211 cites W2172211086 @default.
- W2339446211 cites W2319212703 @default.
- W2339446211 cites W2319522103 @default.
- W2339446211 cites W2319659408 @default.
- W2339446211 cites W2325770519 @default.
- W2339446211 cites W2327227462 @default.
- W2339446211 cites W2328612517 @default.
- W2339446211 cites W2330031850 @default.