A DFT Approach to the Surface-Enhanced Raman Scattering of 4-Cyanopyridine Adsorbed on Silver Nanoparticles
López-Tocón, Isabel, Valdivia, Samuel, Soto, Juan, Otero, Juan Carlos, Muniz-Miranda, Francesco, Menziani, Maria Cristina, Muniz-Miranda, Maurizio
Published in Nanomaterials (Basel, Switzerland) (28.08.2019)
Published in Nanomaterials (Basel, Switzerland) (28.08.2019)
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Journal Article
Sensing Bisphenol A by Means of Surface-Enhanced Raman Spectroscopy and DFT Calculations to Elucidate the Enhancement Mechanism That Dominates the Spectrum
De Souza, Michele Lemos, Valdivia, Samuel, Otero, Juan Carlos, López-Tocón, Isabel
Published in Chemosensors (01.01.2023)
Published in Chemosensors (01.01.2023)
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Journal Article
Theoretical Approaches for Modeling the Effect of the Electrode Potential in the SERS Vibrational Wavenumbers of Pyridine Adsorbed on a Charged Silver Surface
Aranda, Daniel, Valdivia, Samuel, Soto, Juan, López-Tocón, Isabel, Avila, Francisco J, Otero, Juan C
Published in Frontiers in chemistry (05.06.2019)
Published in Frontiers in chemistry (05.06.2019)
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Journal Article
Voltage selection of physisorbed or chemisorbed 4-cyanobenzoate on a nanostructured silver electrode and the dual electronic structure of charged metal–molecule hybrids
Valdivia, Samuel, Avila, Francisco José, Otero, Juan Carlos, López-Tocón, Isabel
Published in Applied surface science (30.03.2022)
Published in Applied surface science (30.03.2022)
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Journal Article
Comparative performance of theoretical tools in order to quantify the effect of the electric potential on the vibrational wavenumbers and intensities of the SERS of 2‐methylpyrazine adsorbed on a nanostructured silver electrode
Valdivia, Samuel, Aranda, Daniel, Soto, Juan, Otero, Juan Carlos, López‐Tocón, Isabel
Published in Journal of Raman spectroscopy (01.02.2023)
Published in Journal of Raman spectroscopy (01.02.2023)
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Journal Article
Charge transfer at the nanoscale and the role of the out-of-plane vibrations in the selection rules of surface-enhanced Raman scattering
Aranda, Daniel, Valdivia, Samuel, Avila, Francisco J, Soto, Juan, Otero, Juan C, López-Tocón, Isabel
Published in Physical chemistry chemical physics : PCCP (28.11.2018)
Published in Physical chemistry chemical physics : PCCP (28.11.2018)
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Journal Article
Remembering the Old Propensity Rules of the Electromagnetic Enhancement Mechanism of SERS: Reorientation of Pyridine on a Silver Electrode Induced by the Applied Potential
Valdivia, Samuel, García-González, Francisco, Aranda, Daniel, Ávila Ferrer, Francisco J., López-Tocón, Isabel, Soto, Juan, Otero, Juan Carlos
Published in Journal of physical chemistry. C (01.08.2024)
Published in Journal of physical chemistry. C (01.08.2024)
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Journal Article
Proving the Dual Electronic Structure of Charged Metal-Molecule Interfaces: Surface-Enhanced Raman Scattering of Cyanide Adsorbed on a Nanostructured Silver Electrode
Valdivia, Samuel, Aranda, Daniel, Ferrer, Francisco José Avila, Soto, Juan, López-Tocón, Isabel, Otero, Juan C
Published in Journal of physical chemistry. C (13.08.2020)
Published in Journal of physical chemistry. C (13.08.2020)
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