Disproving the iceberg effect? A study of the deuteron quadrupole coupling constant of water in a mixture with dimethyl sulfoxide via computer simulations

Kirchner, B, Searles, DJ, Dyson, AJ, Vogt, PS and Huber, H (2000) Disproving the iceberg effect? A study of the deuteron quadrupole coupling constant of water in a mixture with dimethyl sulfoxide via computer simulations. Journal of the American Chemical Society, 122 22: 5379-5383. doi:10.1021/ja994526z


Author Kirchner, B
Searles, DJ
Dyson, AJ
Vogt, PS
Huber, H
Title Disproving the iceberg effect? A study of the deuteron quadrupole coupling constant of water in a mixture with dimethyl sulfoxide via computer simulations
Journal name Journal of the American Chemical Society   Check publisher's open access policy
ISSN 0002-7863
Publication date 2000-06-01
Sub-type Article (original research)
DOI 10.1021/ja994526z
Volume 122
Issue 22
Start page 5379
End page 5383
Total pages 5
Language eng
Keyword Molecular-Dynamics Simulations
Initio Scf Calculations
Liquid Water
Basis Sets
Row Atoms
Dimethylsulfoxide
Abinitio
Q-Index Code C1
Q-Index Status Provisional Code
Institutional Status Unknown

Document type: Journal Article
Sub-type: Article (original research)
Collection: Australian Institute for Bioengineering and Nanotechnology Publications
 
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