Solvent effects on nuclear shielding of neon

Edmond Y Lau, J. T. Gerig

Research output: Contribution to journalArticle

16 Citations (Scopus)

Abstract

Computer simulations of neon dissolved in a variety of organic liquids are used to explore the origins of solvent-induced changes in the neon shielding parameter. Relying on recent theoretical calculations, it is demonstrated that short-range (van der Waals) interactions between the rare gas atom and solvent molecules are the predominant source of the shielding parameter changes. The treatment used leads to calculated solvent-induced changes for solvents as diverse as water and hexane that are in good agreement with experimental observations.

Original languageEnglish (US)
Pages (from-to)3341-3349
Number of pages9
JournalThe Journal of Chemical Physics
Volume103
Issue number9
StatePublished - 1995

Fingerprint

Neon
radiation shielding
neon
Shielding
shielding
Noble Gases
organic liquids
Hexanes
rare gases
computerized simulation
Atoms
Molecules
Water
Computer simulation
Liquids
water
atoms
molecules
interactions

ASJC Scopus subject areas

  • Atomic and Molecular Physics, and Optics

Cite this

Solvent effects on nuclear shielding of neon. / Lau, Edmond Y; Gerig, J. T.

In: The Journal of Chemical Physics, Vol. 103, No. 9, 1995, p. 3341-3349.

Research output: Contribution to journalArticle

Lau, EY & Gerig, JT 1995, 'Solvent effects on nuclear shielding of neon', The Journal of Chemical Physics, vol. 103, no. 9, pp. 3341-3349.
Lau, Edmond Y ; Gerig, J. T. / Solvent effects on nuclear shielding of neon. In: The Journal of Chemical Physics. 1995 ; Vol. 103, No. 9. pp. 3341-3349.
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