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CHEMICAL SOCIETY REVIEWS
Volume 37, Issue 5, Pages 1061-1073Publisher
ROYAL SOC CHEMISTRY
DOI: 10.1039/b706023h
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This critical review highlights recent advances in using electronic structure methods to study surface-enhanced Raman scattering. Examples showing how electronic structure methods, in particular time-dependent density functional theory, can be used to gain microscopic insights into the enhancement mechanism are presented (150 references).
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