Quantum Anharmonic Calculations of Vibrational Spectra for Water Adsorbed on Titania Anatase(101) Surface: Dissociative versus Molecular Adsorption - Archive ouverte HAL Accéder directement au contenu
Article Dans Une Revue Journal of Physical Chemistry C Année : 2022

Quantum Anharmonic Calculations of Vibrational Spectra for Water Adsorbed on Titania Anatase(101) Surface: Dissociative versus Molecular Adsorption

Marco Cazzaniga
Marco Micciarelli
  • Fonction : Auteur
Fabio Gabas
Michele Ceotto

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hal-03872268 , version 1 (25-11-2022)

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Marco Cazzaniga, Marco Micciarelli, Fabio Gabas, Fabio Finocchi, Michele Ceotto. Quantum Anharmonic Calculations of Vibrational Spectra for Water Adsorbed on Titania Anatase(101) Surface: Dissociative versus Molecular Adsorption. Journal of Physical Chemistry C, 2022, pp.12060-12073. ⟨10.1021/acs.jpcc.2c02137⟩. ⟨hal-03872268⟩
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