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400 related items for PubMed ID: 21974546
1. CO2 adsorption on TiO2(101) anatase: a dispersion-corrected density functional theory study. Sorescu DC, Al-Saidi WA, Jordan KD. J Chem Phys; 2011 Sep 28; 135(12):124701. PubMed ID: 21974546 [Abstract] [Full Text] [Related]
7. Interaction of CO2 with oxygen adatoms on rutile TiO2(110). Lin X, Wang ZT, Lyubinetsky I, Kay BD, Dohnálek Z. Phys Chem Chem Phys; 2013 May 07; 15(17):6190-5. PubMed ID: 23364757 [Abstract] [Full Text] [Related]
8. Density functional study of the interaction between small Au clusters, Au(n) (n=1-7) and the rutile TiO2 surface. II. Adsorption on a partially reduced surface. Chrétien S, Metiu H. J Chem Phys; 2007 Dec 28; 127(24):244708. PubMed ID: 18163696 [Abstract] [Full Text] [Related]
10. Adsorption, diffusion, and dissociation of molecular oxygen at defected TiO2(110): a density functional theory study. Rasmussen MD, Molina LM, Hammer B. J Chem Phys; 2004 Jan 08; 120(2):988-97. PubMed ID: 15267936 [Abstract] [Full Text] [Related]
11. Interaction of Pt clusters with the anatase TiO(2)(101) surface: a first principles study. Han Y, Liu CJ, Ge Q. J Phys Chem B; 2006 Apr 13; 110(14):7463-72. PubMed ID: 16599526 [Abstract] [Full Text] [Related]
16. O2 adsorption and dissociation on an anatase (101) surface with a subsurface Ti interstitial. Liu L, Liu Q, Xiao W, Pan C, Wang Z. Phys Chem Chem Phys; 2016 Feb 14; 18(6):4569-76. PubMed ID: 26795028 [Abstract] [Full Text] [Related]
19. Nitrogen/gold codoping of the TiO2(101) anatase surface. A theoretical study based on DFT calculations. Ortega Y, Hernández NC, Menéndez-Proupin E, Graciani J, Sanz JF. Phys Chem Chem Phys; 2011 Jun 21; 13(23):11340-50. PubMed ID: 21566817 [Abstract] [Full Text] [Related]