Simulation of volume polarization for the influence of solvation on chemical shielding

Theoretical Chemistry Accounts

Volumn 111, Issue 2-6, 2004, Pages 61-65

  Chipman, Daniel M ^a  

^a UNIVERSITY OF NOTRE DAME   (United States)

Author keywords

Cavity size; Chemical shielding; Dielectric effects; Reaction field theory; Volume polarization

Indexed keywords

NITROGEN;

ARTICLE; CALCULATION; CHEMICAL REACTION; MOLECULAR PHYSICS; POLARIZATION; REACTION ANALYSIS; SIMULATION; SOLVATION; THEORETICAL STUDY;

EID: 84962394057     PISSN: 1432881X     EISSN: None     Source Type: Journal    
DOI: 10.1007/s00214-003-0515-6     Document Type: Article

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