Pablo A. Denis, FRSC
Pablo A. Denis, FRSC
Researcher, Facultad de Quimica, Universidad de la Repulica Oriental del Uruguay
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Band gap opening of monolayer and bilayer graphene doped with aluminium, silicon, phosphorus, and sulfur
PA Denis
Chemical Physics Letters 492 (4-6), 251-257, 2010
Mechanical properties of graphene nanoribbons
R Faccio, PA Denis, H Pardo, C Goyenola, AW Mombrú
Journal of Physics: Condensed Matter 21 (28), 285304, 2009
Is it possible to dope single‐walled carbon nanotubes and graphene with sulfur?
PA Denis, R Faccio, AW Mombru
ChemPhysChem 10 (4), 715-722, 2009
Comparative study of defect reactivity in graphene
PA Denis, F Iribarne
The Journal of Physical Chemistry C 117 (37), 19048-19055, 2013
Density functional investigation of thioepoxidated and thiolated graphene
PA Denis
The Journal of Physical Chemistry C 113 (14), 5612-5619, 2009
Magnetism induced by single carbon vacancies in a three-dimensional graphitic network
R Faccio, H Pardo, PA Denis, RY Oeiras, FM Araújo-Moreira, ...
Physical Review B 77 (3), 035416, 2008
Structural characterization and chemical reactivity of dual doped graphene
PA Denis, CP Huelmo
Carbon 87, 106-115, 2015
Concentration dependence of the band gaps of phosphorus and sulfur doped graphene
PA Denis
Computational materials science 67, 203-206, 2013
Theoretical characterization of sulfur and nitrogen dual-doped graphene
PA Denis, CP Huelmo, F Iribarne
Computational and Theoretical Chemistry 1049, 13-19, 2014
Theoretical investigation of the stacking interactions between curved conjugated systems and their interaction with fullerenes
PA Denis
Chemical Physics Letters 516 (1-3), 82-87, 2011
When noncovalent interactions are stronger than covalent bonds: Bilayer graphene doped with second row atoms, aluminum, silicon, phosphorus and sulfur
PA Denis
Chemical Physics Letters 508 (1-3), 95-101, 2011
Chemical reactivity and band‐gap opening of graphene doped with gallium, germanium, arsenic, and selenium atoms
PA Denis
ChemPhysChem 15 (18), 3994-4000, 2014
Organic chemistry of graphene: the Diels–Alder reaction
PA Denis
Chemistry–A European Journal 19 (46), 15719-15725, 2013
Complete basis set and density functional determination of the enthalpy of formation of the controversial HO3 radical: a discrepancy between theory and experiment
PA Denis, M Kieninger, ON Ventura, RE Cachau, GHF Diercksen
Chemical physics letters 365 (5-6), 440-449, 2002
Theoretical characterization of hydrogen polyoxides: HOOH, HOOOH, HOOOOH, and HOOO
PA Denis, FR Ornellas
The Journal of Physical Chemistry A 113 (2), 499-506, 2009
Monolayer and bilayer graphene functionalized with nitrene radicals
PA Denis, F Iribarne
The Journal of Physical Chemistry C 115 (1), 195-203, 2011
Chemical reactivity of lithium doped monolayer and bilayer graphene
PA Denis
The Journal of Physical Chemistry C 115 (27), 13392-13398, 2011
Methane adsorption inside and outside pristine and N-doped single wall carbon nanotubes
PA Denis
Chemical Physics 353 (1-3), 79-86, 2008
On the hydrogen addition to graphene
PA Denis, F Iribarne
Journal of Molecular Structure: THEOCHEM 907 (1-3), 93-103, 2009
Beryllium doped graphene as an efficient anode material for lithium-ion batteries with significantly huge capacity: A DFT study
S Ullah, PA Denis, F Sato
Applied Materials Today 9, 333-340, 2017
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