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Vibrational Spectra of a N719-Chromophore/Titania Interface from Empirical-Potential Molecular-Dynamics Simulation, Solvated by a Room Temperature Ionic Liquid
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Calculation and analysis of the harmonic vibrational frequencies in molecules at extreme pressure: methodology and

R Cammi1, C Cappelli, B Mennucci

  • 1Dipartimento di Chimica, Università di Parma, Viale Parco Area delle Scienze 17/A, I-43100 Parma, Italy. roberto.cammi@unipr.it

The Journal of Chemical Physics
|October 23, 2012
PubMed

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