Molecular modelling of a chemodosimeter for the selective detection of As(III) ion in water

Journal of Chemical Sciences

Volumn 120, Issue 6, 2008, Pages 627-635

  Mallajosyula, Sairam S ^a   Usha, H ^a   Datta, Ayan ^a   Pati, Swapan K ^a  

^a JAWAHARLAL NEHRU CENTRE FOR ADVANCED SCIENTIFIC RESEARCH   (India)

Author keywords

Arsenic detection; Chemodosimeter; Density functional theory

Indexed keywords

BINDING STUDIES; CHEMODOSIMETER; COORDINATION SPHERES; DFT LEVELS; HIGH SELECTIVITIES; MOLECULAR MODELLING; QUANTUM CHEMICAL CALCULATIONS; REACTION PATHWAYS; SELECTIVE DETECTIONS;

ARSENIC; BINDING ENERGY; CADMIUM COMPOUNDS; COORDINATION REACTIONS; DENSITY FUNCTIONAL THEORY; DOSIMETERS; DOSIMETRY; MERCURY (METAL); METAL IONS; POLYCYCLIC AROMATIC HYDROCARBONS; QUANTUM CHEMISTRY;

IONS;

EID: 57049136113     PISSN: 02534134     EISSN: 09737103     Source Type: Journal    
DOI: 10.1007/s12039-008-0095-z     Document Type: Article

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