Theoretical study of the hydrated Gd3+ ion: Structure, dynamics, and charge transfer

Journal of Chemical Physics

Volumn 124, Issue 7, 2006, Pages

  Clavagúra, Carine ^a   Calvo, Florent ^a,b   Dognon, Jean Pierre ^a  

^a DIF   (France)

^b European Theoretical Spectroscopy Facility   (France)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; ELECTRONIC STRUCTURE; HYDRATION; MAGNETIC RESONANCE IMAGING; MOLECULAR DYNAMICS; POLARIZATION; RATE CONSTANTS;

DYNAMICAL PROPERTIES; FLUCTUATING CHARGES MODEL; WATER EXCHANGE RATES;

GADOLINIUM COMPOUNDS;

EID: 33244496879     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2167647     Document Type: Article

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