| Stability of native defects in hexagonal and cubic boron nitride W Orellana, H Chacham Physical Review B 63 (12), 125205, 2001 | 212 | 2001 |
| Catalytic Properties of Transition Metal–N4 Moieties in Graphene for the Oxygen Reduction Reaction: Evidence of Spin-Dependent Mechanisms W Orellana The Journal of Physical Chemistry C 117 (19), 9812-9818, 2013 | 178 | 2013 |
| Comparative study of defect energetics in and WL Scopel, AJR Da Silva, W Orellana, A Fazzio Applied physics letters 84 (9), 1492-1494, 2004 | 128 | 2004 |
| Metal-phthalocyanine functionalized carbon nanotubes as catalyst for the oxygen reduction reaction: a theoretical study W Orellana Chemical Physics Letters 541, 81-84, 2012 | 76 | 2012 |
| Small Pd clusters: A comparison of phenomenological and ab initio approaches J Rogan, G García, JA Valdivia, W Orellana, AH Romero, R Ramírez, ... Physical Review B—Condensed Matter and Materials Physics 72 (11), 115421, 2005 | 76 | 2005 |
| Structural, electronic and magnetic properties of vacancies in single-walled carbon nanotubes W Orellana, P Fuentealba Surface science 600 (18), 4305-4309, 2006 | 71 | 2006 |
| Stability and electronic properties of vacancies and antisites in nanotubes J Rossato, RJ Baierle, W Orellana Physical Review B—Condensed Matter and Materials Physics 75 (23), 235401, 2007 | 66 | 2007 |
| First-principles calculations of carbon nanotubes adsorbed on Si (001) W Orellana, RH Miwa, A Fazzio Physical review letters 91 (16), 166802, 2003 | 66 | 2003 |
| Biomimicking vitamin B12. A Co phthalocyanine pyridine axial ligand coordinated catalyst for the oxygen reduction reaction J Riquelme, K Neira, JF Marco, P Hermosilla-Ibáñez, W Orellana, ... Electrochimica Acta 265, 547-555, 2018 | 63 | 2018 |
| In search of the most active MN4 catalyst for the oxygen reduction reaction. The case of perfluorinated Fe phthalocyanine G Abarca, M Viera, C Aliaga, JF Marco, W Orellana, JH Zagal, F Tasca Journal of Materials Chemistry A 7 (43), 24776-24783, 2019 | 53 | 2019 |
| Diffusion in : Triplet versus Singlet W Orellana, AJR da Silva, A Fazzio Physical review letters 87 (15), 155901, 2001 | 51 | 2001 |
| Oxidation at the Interface: Influence of the Spin Degree of Freedom W Orellana, AJR Da Silva, A Fazzio Physical review letters 90 (1), 016103, 2003 | 47 | 2003 |
| Alternative search strategy for minimal energy nanocluster structures: The case of rhodium, palladium, and silver J Rogan, G García, C Loyola, W Orellana, R Ramírez, M Kiwi The Journal of chemical physics 125 (21), 2006 | 46 | 2006 |
| Diffusion-reaction mechanisms of nitriding species in W Orellana, AJR Da Silva, A Fazzio Physical Review B—Condensed Matter and Materials Physics 70 (12), 125206, 2004 | 46 | 2004 |
| Energetics of carbon and oxygen impurities and their interaction with vacancies in cubic boron nitride W Orellana, H Chacham Physical Review B 62 (15), 10135, 2000 | 46 | 2000 |
| Oxygen reduction reaction at penta-coordinated Co phthalocyanines M Viera, J Riquelme, C Aliaga, JF Marco, W Orellana, JH Zagal, F Tasca Frontiers in Chemistry 8, 22, 2020 | 45 | 2020 |
| Substrate-dependent electronic properties of an armchair carbon nanotube adsorbed on H∕ Si (001) RH Miwa, W Orellana, A Fazzio Applied Physics Letters 86 (21), 2005 | 44 | 2005 |
| Atomic geometry and energetics of vacancies and antisites in cubic boron nitride W Orellana, H Chacham Applied physics letters 74 (20), 2984-2986, 1999 | 44 | 1999 |
| Optical response of carbon nanotubes functionalized with (free-base, Zn) porphyrins, and phthalocyanines: A DFT study JD Correa, W Orellana Physical Review B—Condensed Matter and Materials Physics 86 (12), 125417, 2012 | 39 | 2012 |
| Hydrogen storage on cation-decorated biphenylene carbon and nitrogenated holey graphene R Guerrero-Avilés, W Orellana International Journal of Hydrogen Energy 43 (51), 22966-22975, 2018 | 38 | 2018 |
Adalberto FazzioDirector, Brazilian Nanotechnology National Laboratory (LNNano/CNPEM)Verified email at lnnano.cnpem.br
