Revisiting caffeate's capabilities as a complexation agent to silver cation in mining processes by means of the dual descriptor-A conceptual DFT approach

Journal of Molecular Modeling

Volumn 18, Issue 9, 2012, Pages 4299-4307

  Martínez Araya, Jorge Ignacio ^a  

^a UNIVERSIDAD PEDRO DE VALDIVIA   (Chile)

Author keywords

Caffeate anion; Complexation agent; Dual descriptor; Ligand; Local reactivity; Silver exploitation .

Indexed keywords

ANION; CAFFEIC ACID; SILVER;

ARTICLE; COMPLEX FORMATION; DENSITY FUNCTIONAL THEORY; GAS; MINING; PRIORITY JOURNAL; QUANTUM CHEMISTRY; THERMODYNAMICS;

CAFFEIC ACIDS; CATIONS; LIGANDS; MINING; MODELS, MOLECULAR; MOLECULAR CONFORMATION; OXYGEN; QUANTUM THEORY; SILVER; STATIC ELECTRICITY; THERMODYNAMICS;

EID: 84867581901     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-012-1405-4     Document Type: Article

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