화학공학소재연구정보센터
검색결과 : 9건
No. Article
1 A DFT study of the stoichiometric and reduced anatase (001) surfaces
Ortega Y, Hevia DF, Oviedo J, San-Miguel MA
Applied Surface Science, 294, 42, 2014
2 V@Au-12(-): An improved novel catalyst for CO oxidation?
Graciani J, Oviedo J, Sanz JF
Journal of Physical Chemistry B, 110(23), 11600, 2006
3 Ba adsorption on the stoichiometric and defective TiO2 (110) surface from first-principles calculations
Miguel MAS, Oviedo J, Sanz JF
Journal of Physical Chemistry B, 110(39), 19552, 2006
4 N2O decomposition on TiO2 (110) from dynamic first-principles calculations
Oviedo J, Sanz JF
Journal of Physical Chemistry B, 109(34), 16223, 2005
5 Oxygen vacancies on TiO2 (110) from first principles calculations
Oviedo J, San Miguel MA, Sanz JF
Journal of Chemical Physics, 121(15), 7427, 2004
6 Amorphous structures of Cu, Ag, and Au nanoclusters from first principles calculations
Oviedo J, Palmer RE
Journal of Chemical Physics, 117(21), 9548, 2002
7 Molecular dynamics simulations of the structure of Pd clusters deposited on the MgO(001) surface
Oviedo J, Sanz JF, Lopez N, Illas F
Journal of Physical Chemistry B, 104(18), 4342, 2000
8 Molecular dynamics simulations of the MgO(001) surface hydroxylation
Oviedo J, Calzado CJ, Sanz JF
Journal of Chemical Physics, 108(10), 4219, 1998
9 Geometric and Electronic-Structure of Amorphous Aluminophosphates - Ab-Initio and Experimental Studies
Marquez AM, Oviedo J, Sanz JF, Benitez JJ, Odriozola JA
Journal of Physical Chemistry B, 101(46), 9510, 1997