Beyond isotropic tumbling models: Nuclear spin relaxation in liquids from first principles

ChemPhysChem

Volumn 9, Issue 16, 2008, Pages 2313-2316

  Schmidt, Jochen ^b   Hutter, Jürg ^c   Spiess, Hans Wolfgang ^a   Sebastiani, Daniel ^a  

^a MAX PLANCK INSTITUTE FOR POLYMER RESEARCH   (Germany)

^b FRANKFURT INSTITUTE FOR ADVANCED STUDIES   (Germany)

^c UNIVERSITY OF ZURICH   (Switzerland)

Author keywords

Density functional calculations; Liquids; Molecular dynamics; NMR spectroscopy; Solvation

Indexed keywords

CALCULATIONS; DENSITY FUNCTIONAL THEORY; LIQUIDS; MOLECULAR DYNAMICS; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; SOLVATION;

AMBIENT CONDITIONS; AUTOCORRELATION FUNCTIONS; EXPONENTIAL DECAYS; FIRST PRINCIPLES; LIQUID WATER; MD SIMULATION; NUCLEAR SPIN RELAXATION;

DENSITY OF LIQUIDS;

EID: 55549119626     PISSN: 14394235     EISSN: 14397641     Source Type: Journal    
DOI: 10.1002/cphc.200800435     Document Type: Article

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