Theoretical study on the role of surface basicity and lewis acidity on the etherification of glycerol over alkaline earth metal oxides

Chemistry - A European Journal

Volumn 15, Issue 41, 2009, Pages 10864-10870

  Calatayud, Monica ^a   Ruppert, Agnieszka M ^b,c   Weckhuysen, Bert M ^b  

^a LABORATOIRE DE CHIMIE THÉORIQUE   (France)

^b UTRECHT UNIVERSITY   (Netherlands)

^c LODZ UNIVERSITY OF TECHNOLOGY   (Poland)

Author keywords

Alkaline earth metals; Basicity; Density functional calculations; Glycerol; Heterogeneous catalysis; Renewable resources

Indexed keywords

ACID BASE; ADSORPTION ENERGIES; ADSORPTION MODES; ADSORPTION PROCESS; BASICITY; DENSITY FUNCTIONAL CALCULATIONS; DENSITY FUNCTIONAL THEORY CALCULATIONS; DISSOCIATIVE ADSORPTION; EXPERIMENTAL DATA; HETEROGENEOUS CATALYSIS; HYDROXYL GROUPS; LATTICE OXYGEN ATOMS; LEAVING GROUPS; LEWIS ACID SITE; LEWIS ACIDITY; REACTION MECHANISM; REGULAR SURFACES; RENEWABLE RESOURCES; STRUCTURAL PARAMETER; SUGAR ALCOHOLS; SURFACE BASICITY; THEORETICAL STUDY;

ACIDS; ADSORPTION; BARIUM; CALCIUM; CATALYSIS; DISSOCIATION; GLYCEROL; LIGHT METALS; METALLIC COMPOUNDS; METALS; OXIDES; OXYGEN; SUGAR (SUCROSE); SUGARS; SURFACE DEFECTS;

DENSITY FUNCTIONAL THEORY;

EID: 70350215670     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.200900487     Document Type: Article

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