Flores-Livas, J. A., Debord, R. ., Botti, S. ., San Miguel, A. ., Marques, M. ., & Pailhes, S. . (2011). Enhancing the superconducting transition temperature of BaSi2 by structural tuning. Phys. Rev. Lett., 106, 087002. https://doi.org/10.1103/PhysRevLett.106.087002
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Marques
Oliveira, M. ., Botti, S. ., & Marques, M. . (2011). Modeling van der Waals interactions between proteins and inorganic surfaces from time-dependent density functional theory calculations. Phys. Chem. Chem. Phys., 13, 15055. https://doi.org/10.1039/c1cp20719a
Flores-Livas, J. A., Debord, R. ., Botti, S. ., San Miguel, A. ., Pailhes, S. ., & Marques, M. . (2011). Superconductivity in Layered Binary Silicides: A density functional theory study. Phys. Rev. B, 84, 184503. https://doi.org/10.1103/PhysRevB.84.184503
Vilhena, J. G., Botti, S. ., & Marques, M. . (2010). Excitonic effects in the optical properties of CdSe nanowires. Appl. Phys. Lett., 96, 123106. https://doi.org/10.1063/1.3368126
Trani, F. ., Vidal, J. ., Botti, S. ., & Marques, M. . (2010). Band structures of delafossite transparent conductive oxides from a self-consistent GW approach. Phys. Rev. B, 82, 085115. https://doi.org/10.1103/PhysRevB.82.085115
Vidal, J. ., Trani, F. ., Bruneval, F. ., Marques, M. ., & Botti, S. . (2010). Effects of Electronic and Lattice Polarization on the Band Structure of Delafossite Transparent Conductive Oxides. Phys. Rev. Lett., 104, 136401. https://doi.org/10.1103/PhysRevLett.104.136401
Botti, S. ., Weissker, H.-C. ., & Marques, M. . (2009). Alloying effects on the optical properties of Ge1-xSix nanocrystals from time-dependent density functional theory and comparison with effective-medium theory. Phys. Rev. B, 79, 155440. https://doi.org/10.1103/PhysRevB.79.155440
Castro, A. ., Marques, M. ., Varsano, D. ., Sottile, F. ., & Rubio, A. . (2009). The challenge of predicting optical properties of biomolecules: what can we learn from time-dependent density-functional theory?. Comptes Rendus De Physique, 10, 469-490. https://doi.org/10.1016/j.crhy.2008.09.001
Botti, S. ., Castro, A. ., Lathiotakis, N. N., Andrade, X. ., & Marques, M. . (2009). Optical and magnetic properties of boron fullerenes. Phys. Chem. Chem. Phys, 11, Page 4523. https://doi.org/10.1039/b902278c
Botti, S. ., Castro, A. ., Andrade, X. ., Rubio, A. ., & Marques, M. . (2008). Cluster-surface and cluster-cluster interactions: Ab initio calculations and modeling of asymptotic van der Waals forces. PHYSICAL REVIEW B, 78, 035333. https://doi.org/10.1103/PhysRevB.78.035333 (Original work published 2025)