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Hapiuk, D. ., Marques, M. ., Melinon, P. ., Flores-Livas, J. A., Botti, S. ., & Masenelli, B. . (2012). p-doping in expanded phase of ZnO: An ab initio study. Phys. Rev. Lett., 108, 115903. https://doi.org/10.1103/PhysRevLett.108.115903
Flores-Livas, J. A., Lehtovaara, L. ., Amsler, M. ., Goedecker, S. ., Pailhes, S. ., Botti, S. ., … Marques, M. . (2012). Raman activity of sp3 carbon allotropes under pressure: A density functional theory study. Phys. Rev. B, 85, 155428. https://doi.org/10.1103/PhysRevB.85.155428
Amsler, M. ., Flores-Livas, J. A., Lehtovaara, L. ., Balima, F. ., Ghasemi, S. ., Machon, D. ., … Marques, M. . (2012). Crystal structure of cold compressed graphite. Phys. Rev. Lett., 108, 065501. https://doi.org/10.1103/PhysRevLett.108.065501
Botti, S. ., Flores-Livas, J. A., Amsler, M. ., Goedecker, S. ., & Marques, M. . (2012). Low-energy silicon allotropes with strong absorption in the visible for photovoltaic applications. Phys. Rev. B (Rapid Comm.), 86, 121204. https://doi.org/10.1103/PhysRevB.86.121204
Amsler, M. ., Flores-Livas, J. A., Huan, T. ., Botti, S. ., Marques, M. ., & Goedecker, S. . (2012). Novel Structural Motifs in Low Energy Phases of LiAlH4. Phys. Rev. Lett., 108, 205505. https://doi.org/10.1103/PhysRevLett.108.205505
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
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