Radiation-induced radicals in α-d-glucose: Comparing DFT cluster calculations with magnetic resonance experiments

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 63, Issue 4, 2006, Pages 795-801

  Pauwels, Ewald ^a   Speybroeck, Veronique Van ^a   Waroquier, Michel ^a  

^a GHENT UNIVERSITY   (Belgium)

Author keywords

d Glucose; Cluster calculations; DFT; EPR; Hydrogen bonds; Radicals; Solid state

Indexed keywords

HYDROGEN BONDS; MAGNETIC RESONANCE; PROBABILITY DENSITY FUNCTION; TENSORS;

DFT; RADICALS; SOLID STATE;

GLUCOSE;

GLUCOSE;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; ELECTRON SPIN RESONANCE; RADIATION EXPOSURE;

ELECTRON SPIN RESONANCE SPECTROSCOPY; GLUCOSE; MODELS, MOLECULAR;

EID: 33644906103     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2005.10.027     Document Type: Article

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