Study of binding energies using DFT methods, vibrational frequencies and solvent effects in the interaction of silver ions with uracil tautomers

Arabian Journal of Chemistry

Volumn 10, Issue , 2017, Pages S786-S799

  Tavakol, Hossein ^a  

^a ISFAHAN UNIVERSITY OF TECHNOLOGY   (Iran)

Author keywords

AIM; DFT; Interaction; NBO; Silver; Tautomer; Uracil

Indexed keywords

AROMATIC COMPOUNDS; ATOMS; BINS; CHARGE TRANSFER; CHEMICAL BONDS; COMPLEXATION; COORDINATION REACTIONS; GASES; IONS; METAL IONS; MOLECULAR OXYGEN; SILVER; SOLVENTS; STRETCHING;

EFFECTIVE INTERACTIONS; INTERACTION; INTERACTION ENERGIES; NATURAL BOND ORBITAL; OPTIMIZED STRUCTURES; STRETCHING VIBRATIONS; TAUTOMER; URACIL;

BINDING ENERGY;

EID: 84872079832     PISSN: 18785352     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.arabjc.2012.12.007     Document Type: Article

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