Growth modification of seeded calcite using carboxylic acids: Atomistic simulations

Journal of Colloid and Interface Science

Volumn 346, Issue 1, 2010, Pages 226-231

  Aschauer, Ulrich ^a,c   Spagnoli, Dino ^b,d   Bowen, Paul ^a   Parker, Stephen C ^b  

^a EPFL   (Switzerland)

^b University of Bath Claverton Down   (United Kingdom)

^c PRINCETON UNIVERSITY   (United States)

^d CURTIN UNIVERSITY   (Australia)

Author keywords

Adsorption; Atomistic simulation; Calcite; Calcium carbonate; Polycarboxylic acids

Indexed keywords

ADSORPTION ENERGIES; ADSORPTION FREE ENERGY; ATOMISTIC SIMULATION; ATOMISTIC SIMULATIONS; CALCITE GROWTH; CALCITE PARTICLES; CALCITE SURFACE; COUNTERIONS; ELECTROSTATIC INTERACTIONS; ENTROPIC CONTRIBUTIONS; INHIBITING EFFECT; MODIFYING EFFECTS; MOLECULAR DYNAMICS SIMULATIONS; NEGATIVE ADSORPTION; ORDERED WATER; ORGANIC ADDITIVES; POLYACRYLIC ACIDS; POLYASPARTIC ACID; POLYCARBOXYLIC ACIDS; POSITIVE ENERGIES; RESIDENCE TIME; STABLE COMPLEXES; SURFACE ADSORPTION;

CALCITE; CALCIUM; CALCIUM CARBONATE; CARBONATE MINERALS; CARBOXYLIC ACIDS; COMPLEXATION; MOLECULAR DYNAMICS; ORGANIC ACIDS;

ADSORPTION;

CALCIUM CARBONATE; CARBOXYLIC ACID; POLYACRYLIC ACID; POLYASPARTIC ACID;

ADSORPTION; ALGORITHM; ARTICLE; CATALYSIS; CHEMICAL BINDING; CHEMICAL MODIFICATION; CONTROLLED STUDY; DISSOLUTION; HYDROGEN BOND; MOLECULAR DYNAMICS; MORPHOLOGY; PARTICLE SIZE; PRIORITY JOURNAL; SIMULATION; ZETA POTENTIAL;

ACRYLIC RESINS; ADSORPTION; CALCIUM CARBONATE; MODELS, MOLECULAR; MOLECULAR DYNAMICS SIMULATION; PARTICLE SIZE; PEPTIDES; SURFACE PROPERTIES; TIME FACTORS;

EID: 77952584961     PISSN: 00219797     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jcis.2010.02.057     Document Type: Article

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