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    How do adsorbent orientation and direction of external electric field affect the charge-transfer surface-enhanced raman spectra?

    , Article Journal of Physical Chemistry C ; Volume 125, Issue 24 , 2021 , Pages 13382-13390 ; 19327447 (ISSN) Ashtari Jafari, S ; Jamshidi, Z ; Sharif University of Technology
    American Chemical Society  2021
    Abstract
    Surface-enhanced Raman spectroscopy is a highly sensitive phenomenon and a powerful fingerprint detection tool that reflects the small changes in polarizability on the pattern and intensity of Raman signals. The SERS enhancement signals elucidate with the surface-selection rules. In this regard, molecular configuration and adsorption orientation on the surface, in addition to the direction of external electric field, can lead to different patterns of SERS spectra. To evaluate how the variation of these features influences the pattern and reproducibility of the spectra, the chemical charge-transfer SERS spectra for pyridine on silver clusters are calculated for different field directions,...