Insights into the adsorption of organic molecules on rutile TiO2 (1 1 0) surface: A theoretical study (original) (raw)

Adsorption of Large Organic Molecules on Clean and Hydroxylated Rutile TiO2(110) Surfaces

André Gourdon

ChemPhysChem, 2000

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DFT study of carboxylic acids modes of adsorption on rutile TiO2(011) surfaces

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Theoretical Study of Adsorption of O(3P) and H2O on the Rutile TiO2(110) Surface

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Adsorption of Water on Reconstructed Rutile TiO 2 (011)-(2×1): TiO Double Bonds and Surface Reactivity

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A computational study of the interaction of oxygenates with the surface of rutile TiO2(110). Structural and electronic trends

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Molecular Chemisorption on TiO 2 (110): A Local Point of View

Maurizio Casarin

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Adsorption of small hydrocarbons on rutile TiO 2 (110)

Zdenek Dohnálek

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Adsorption of benzene over the rutile TiO2 (110) surfaces: A theoretical study

Horacio Alves

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Structural study of adsorption of isonicotinic acid and related molecules on rutile TiO2(110) I: XAS and STM

Petter Persson

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Adsorption of a chiral modifier on an oxide surface: Chemical nature of tartaric acid on rutile TiO2 (110)

Pascal David

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Density functional studies of molecular chemisorption on TiO 2 (110

Maurizio Casarin

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Adsorption and dissociation of ammonia on clean and metal-covered TiO2 rutile (110) surfaces: A comparative DFT study

Daojian Cheng

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Understanding Acetaldehyde Thermal Chemistry on the TiO 2 (110) Rutile Surface: From Adsorption to Reactivity

Veronica Collico, Jose Plata, Antonio Márquez

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Molecular simulation for gas adsorption at TiO2 (rutile and anatase) surface

Hsin-Fu Lin

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Molecular Adsorption of H2O on TiO2 and TiO2:Y Surfaces

DILSHOD D . NEMATOV

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ELECTRONIC PROPERTIES OF CATECHOL ADSORBED ON RUTILE TiO_2 AND SnO_2 (110) SURFACES: A DENSITY FUNCTIONAL THEORY STUDY

Maurice Okoth

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Adsorbate-Induced Modification of Surface Electronic Structure: Pyrocatechol Adsorption on the Anatase TiO 2 (101) and Rutile TiO 2 (110) Surfaces

Ben Spencer

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Carboxylic species adsorption on TiO2 nanoparticles

Elena Sheka

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Adsorption and nonadiabatic processes in the photodesorption of molecular oxygen from the reduced TiO 2 (110) surface

Octavio Roncero

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Combined NC-AFM and DFT study of the adsorption geometry of trimesic acid on rutile TiO2(110)

Marcin Kaczmarski

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Nature of the excited states of the rutile TiO2() surface with adsorbed water

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Modeling Kinetics of Water Adsorption on the Rutile TiO2 (110) Surface: Influence of Exchange-Correlation Functional

Baochang Wang

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4-Mercaptobenzoic Acid Adsorption on TiO2 Anatase (101) and TiO2 Rutile (110) Surfaces

Claudia Lorena Compean Gonzalez

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Adsorption of bi-isonicotinic acid on rutile TiOsub 2

Sten Lunell

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Theoretical Analysis of K Adsorption on TiO 2 (110) Rutile Surface

Javier Fdez Sanz

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Adsorption of CH 3 COOH on TiO 2 : IR and theoretical investigations

Gianmario Martra

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Adsorption of organic molecules at the TiO2(110) surface: The effect of van der Waals interactions

Peter Brett, Ricardo Grau-Crespo

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Theoretical insights into the surface growth of rutile TiO2

Uwe Riedel

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