Projects per year
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Collaborations and top research areas from the last five years
Projects
- 2 Finished
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LASHG/MM: Liquid-Air Interfacial Second Harmonic Generation Responses Probed by Multiscale Molecular Modeling
Ramos, T. N. (PI) & CHAMPAGNE, B. (Supervisor)
1/10/22 → 30/09/25
Project: Research
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Dynamical Chromophore-Ion Interactions Probed by their Nonlinear Optical Properties – a Multi-Scale Theoretical Chemistry Investigation
Ramos, T. N. (PI) & CHAMPAGNE, B. (PI)
1/03/20 → 28/02/22
Project: Research
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Assessing Structural and Optical Properties of PTQ10-Based Donor Polymers in Solution for Eco-Friendly Photovoltaics: A Multiscale Modeling Study
Ribeiro, R. B., Franco, L. R., Holmes, A., Ramos, T. N., Wang, E., Varella, M. T. D. N. & Araujo, C. M., 12 Jun 2025, In: The Journal of Physical Chemistry. B, Condensed matter, materials, surfaces, interfaces & biophysical. 129, 23, p. 5887-5900 14 p.Research output: Contribution to journal › Article › peer-review
Open Access -
Atropisomerism in Triarylboranes: Lewis Base Assisted Rotation at C−B Stereogenic Axis in Asymmetrical Boron Lewis Acids
Doan, T. H., Chardon, A., Vanthuyne, N., Ramos, T. N., Tumanov, N., Fusaro, L., Albalat, M., Collard, L., Wouters, J., Champagne, B. & Berionni, G., 25 Apr 2025, In: Angewandte Chemie. International edition. 64, 18, e202421931.Research output: Contribution to journal › Article › peer-review
Open AccessFile8 Downloads (Pure) -
Modeling second harmonic generation at alcohol/air interfaces. A molecular multi-layer approach
Ramos, T. N. & Champagne, B., 15 Jun 2025, In: Journal of Molecular Liquids. 428, p. 127499 127499.Research output: Contribution to journal › Article › peer-review
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Quantum chemical investigation of a multistate multifunctional molecular switch triggered by two-photon absorption
Deveaux, N., Champagne, B., Beaujean, P., Ramos, T. N. & Pires Valverde, D., Aug 2025, In: Theoretical Chemistry Accounts. 144, 8, 62.Research output: Contribution to journal › Article › peer-review
Open AccessFile25 Downloads (Pure) -
Temperature effects on the conformational dynamics and nonlinear optical properties of donor–acceptor Stenhouse adducts in chloroform solution
Dellai, A., Naim, C., Ramos, T. N., Champagne, B., Prampolini, G. & Castet, F., Aug 2025, In: Theoretical Chemistry Accounts. 144, 8, 65.Research output: Contribution to journal › Article › peer-review
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Calculation of the One- and Two-Photon Absorption Spectra of Water-Soluble Stilbene Derivatives Using a Multiscale QM/MM Approach
Ramos, T. N. (Speaker)
5 Jul 2024Activity: Talk or presentation types › Oral presentation
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Congress of Theoretical Chemists of Latin Expression (Chimistes Théoriciens d'Expression Latine) 2024
Beaujean, P. (Member of Organizing Committee), Bonvicini, A. (Member of Organizing Committee), Champagne, B. (Organiser), Liegeois, V. (Member of Organizing Committee), Ramos, T. N. (Member of Organizing Committee), Olivier, Y. (Organiser), HENRARD, L. (Organiser), Michaux, C. (Organiser), Adjieufack, A. I. (Member of Organizing Committee) & Pires Valverde, D. (Member of Organizing Committee)
30 Jun 2024 → 5 Jul 2024Activity: Participating in or organising an event types › Participation in conference
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Second Harmonic Generation Responses of Liquid Water Using Sequential QM/MM: from Bulk to Interface
Ramos, T. N. (Speaker)
22 Apr 2024Activity: Talk or presentation types › Oral presentation
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Universite Bordeaux
Ramos, T. N. (Invited researcher)
22 Feb 2024Activity: Visiting an external institution types › Visiting an external academic institution
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Unraveling the Second Harmonic Generation Responses at the Liquid-Vacuum Interfaces
Ramos, T. N. (Speaker)
30 Nov 2023Activity: Talk or presentation types › Oral presentation
Press/Media
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University of Namur Reports Findings in Science (Atropisomerism in Triarylboranes: Lewis Base Assisted Rotation at C-B Stereogenic Axis in Asymmetrical Boron Lewis Acids)
Champagne, B., Wouters, J., Fusaro, L., Tumanov, N., Berionni, G. & Ramos, T. N.
24/03/25
1 item of Media coverage
Press/Media: Expert Comment
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Atropisomerism in Triarylboranes
Champagne, B., Wouters, J., Fusaro, L., Tumanov, N., Berionni, G. & Ramos, T. N.
20/02/25
1 item of Media coverage
Press/Media: Expert Comment
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University of Namur Reports Findings in Chemical Physics (First hyperpolarizability of the di-8-ANEPPS and DR1 nonlinear optical chromophores in solution. An experimental and multi-scale theoretical chemistry study)
Champagne, B., Beaujean, P. & Ramos, T. N.
20/11/23
1 item of Media coverage
Press/Media: Expert Comment