Guillaume Thiam
4
Documents
Présentation
Currently working on low energy electron interactions with molecules in the DFT/TD-DFT framework.
Publications
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How Accurately Can DFT Describe Non-valence Anions?Journal of Chemical Theory and Computation, 2023, 19 (10), pp.2842-2849. ⟨10.1021/acs.jctc.3c00099⟩
Article dans une revue
hal-04156373v1
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Experimental and Theoretical Studies of Dissociative Electron Attachment to Metabolites Oxaloacetic and Citric AcidsInternational Journal of Molecular Sciences, 2021, 22 (14), pp.7676. ⟨10.3390/ijms22147676⟩
Article dans une revue
hal-03323228v1
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Multi-Basis-Set (TD-)DFT Methods for Predicting Electron Attachment EnergiesJournal of Physical Chemistry Letters, 2021, 12 (41), pp.9995-10001. ⟨10.1021/acs.jpclett.1c02980⟩
Article dans une revue
hal-03418629v1
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Decomposition of Carbon Tetrachloride on Gold SurfacesJournal of Physical Chemistry C, 2020, 124 (38), pp.20874-20880. ⟨10.1021/acs.jpcc.0c04492⟩
Article dans une revue
hal-02955776v1
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