| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5374539 | Chemical Physics | 2012 | 8 Pages |
Abstract
⺠Ground and excited state geometry optimizations of pyridine on Ag. ⺠Calculates serve as starting point for time correlator methods. ⺠Raman cross sections calculated employing the two-time correlator method valid for all frequencies and temperatures. ⺠Results suggest that resonance Raman could be the dominate mechanism in SERS. ⺠Both charge transfer and metal d â p band transitions can couple to Raman active modes.
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Authors
John Gaff, Stefan Franzen,