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Guest Scientist

Vania Martins Ramos
University of Vienna
Institute of Theoretical Chemistry
Währinger Str. 17
1090 Vienna
Austria

vaniar96@univie.ac.at

ORCID: 0000-0002-6451-7493
Focus Area
My research focuses on the theoretical investigation of the photophysical properties and excited-state dynamics of selected transition-metal complexes. In particular, I study compounds based on Earth-abundant 3d transition metals as potential low-cost alternatives for photosensitizer applications. By characterizing their electronic structure and light-induced processes, my work aims to contribute to the rational design of efficient and sustainable photoactive materials.
Publications
    7. L. G. A. do Nascimento, S. S. Souza, P. H. O. Santiago, V. M. Ramos, J. Ellena, A. P. de Lima Batista, S. Nikolaou
    Investigating the Spectroscopic Properties and Interaction with DNA of New RuII-Naphthalimide Complexes
    Spectrochim. Acta A Mol. Biomol. Spectrosc. 362, 128140, (2026), DOI: 10.1016/j.saa.2026.128140

    6. R. R. Bertoloni, V. M. Ramos, A. P. de Lima Batista, A. G. S. de Oliveira-Filho
    Benchmarking Structures and UV–Vis Spectra of Iron Complexes Against Experimental Data
    J. Phys. Chem. A 129, 10481-10495, (2025), DOI: 10.1021/acs.jpca.5c06391

    5. V. M. Ramos, B. C. Severino, A. P. de Lima Batista
    Abordagens DFT para Espectros de Absorção UV-Vis: Explorando Semelhanças e Diferenças em Composto Orgânico e de Coordenação
    Quim. Nova 48, e-20250179, 1-12, (2025), DOI: 10.21577/0100-4042.20250179

    Cover Image:
    Abordagens DFT para Espectros de Absorção UV-Vis: Explorando Semelhanças e Diferenças em Composto Orgânico e de Coordenação
    Quim. Nova 48, No. 8, (2025)

    4. R. Paiva, S. H. F. Bonatti, C. Estremera, M. Wrona, V. M. Ramos, A. P. de Lima Batista, L. H. Staffa, C. Nerín, S. A. Cruz
    How Carbodiimide Modulates Oligomer Migration and Molar Mass in Recycled Poly(Lactic Acid): A Study Using UPLC-QTOF-MSE
    ACS Appl. Polym. Mater. 6, 15230-15241, (2024), DOI: 10.1021/acsapm.4c03030

    3. V. M. Ramos, B. C. Severino, F. M. Brugnari, L. de Lima Conceição, A. S. Rocha, A. P. de Lima Batista
    Assessing and Applying DFT Approaches for Geometries and UV-Vis Absorption Spectra of Tetragonal Iron(II) Complexes
    Theor. Chem. Acc. 143, 72, (2024), DOI: 10.1007/s00214-024-03150-9

    2. V. M. Ramos, A. G. S. de Oliveira-Filho, A. P. de Lima Batista
    Homogeneous Catalytic CO2 Hydrogenation by [Fe]-Hydrogenase Bioinspired Complexes: A Computational Study
    J. Phys. Chem. A 126, 2082-2090, (2022), DOI: 10.1021/acs.jpca.1c09761

    1. N. M. Perez, G. Y. Higashijima, V. M. Ramos, A. P. de Lima Batista, S. Nikolaou
    Probing Solvent Effects on the Absorption Spectrum of Oxo-Centered Carbonyl-Triruthenium Clusters
    Polyhedron 194, 114944, (2021), DOI: 10.1016/j.poly.2020.114944

Contact:
Univ.-Prof. Dr. Dr. h.c. Leticia González

Universität Wien
Institut für Theoretische Chemie
Währinger Str. 17 A-1090 Wien

phone:
+43-1-4277-52751 (secretary)
+43-1-4277-52750 (Prof. González)

email: office.theochem@univie.ac.at

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