Browsing by Author "Montero Alejo, Ana"

Now showing items 1-3 of 3

    • Electronic excitations of C 60 aggregates 
      Montero Alejo, Ana; Menéndez Proupin, Eduardo; Fuentes, M. E.; Delgado, A.; Montforts, F. P.; Montero Cabrera, Luis; García de la Vega, José M. (2012)
      Excitation properties of the isolated C 60 and (C 60) N model clusters (N = 2, 3, 4, 6 and 13) are studied using an a priori parameterized and self-consistent Hamiltonian, the Complete Neglect of Differential Overlap ...
    • Infuence of chromium hyperdoping on the electronic structure of CH3NH3PbI3 perovskite: a frst-principles insight 
      García, Gregorio; Palacios, Pablo; Menendez Proupin, Eduardo; Montero Alejo, Ana; Conesa, J. C.; Wahnon, Perla (Nature, 2018)
      Organic-inorganic hybrid halide perovskites compounds are emerging as new materials with great potential for efcient solar cells. This paper explores the possibility of increasing their photovoltaic efciency through ...
    • Ultrathin carbon nanotube with single, double, and triple bonds 
      Menéndez Proupin, Eduardo; Montero Alejo, Ana; García de la Vega, José M. (2012)
      A metastable carbon nanotube with single, double, and triple bonds has been predicted from abinitio simulation. It results from the relaxation of an ideal carbon nanotube with chirality (2,1), without any potential barrier ...