Dissociative binding of carboxylic acid ligand on nanoceria surface in aqueous solution: A joint in situ spectroscopic characterization and first-principles study

Journal of Physical Chemistry C

Volumn 117, Issue 46, 2013, Pages 24329-24338

  Lu, Zhou ^a   Karakoti, Ajay ^a   Velarde, Luis ^a   Wang, Weina ^a   Yang, Ping ^a   Thevuthasan, Suntharampillai ^a   Wang, Hong Fei ^a  

^a PACIFIC NORTHWEST NATIONAL LABORATORY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

DISSOCIATIVE ADSORPTION; FIRST-PRINCIPLES STUDY; METAL OXIDE NANOPARTICLES; SPECTROSCOPIC CHARACTERIZATION; SPECTROSCOPIC EVIDENCE; SPIN-POLARIZED DENSITY FUNCTIONAL THEORY; SUM-FREQUENCY GENERATION; THERMODYNAMICALLY STABLE;

ADSORPTION; BINDING ENERGY; CALCULATIONS; CARBOXYLATION; CARBOXYLIC ACIDS; DENSITY FUNCTIONAL THEORY; LIGANDS; NANOPARTICLES; OXIDATION; SOLUTIONS; SURFACES;

DISSOCIATION;

EID: 84888635155     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp4068747     Document Type: Article

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