Intermolecular hyperfine tensor for Xe@O2. Density and temperature dependence of Xe chemical shifts in oxygen gas

Autor:	Lela Vuković, Devin N. Sears, Cynthia J. Jameson
Rok vydání:	2006
Předmět:	Chemistry Chemical shift Intermolecular force Biophysics Condensed Matter Physics Mole fraction Quality (physics) Molecule Tensor Physical and Theoretical Chemistry Atomic physics Molecular Biology Hyperfine structure Quantum
Zdroj:	Molecular Physics. 104:1217-1225
ISSN:	1362-3028 0026-8976
DOI:	10.1080/00268970500525614
Popis:	For the first time, the intermolecular hyperfine tensor at a 129Xe nucleus close to an O2 molecule has been calculated for various configurations. The quality of this quantum mechanical calculation has been tested against the experimentally measured density and temperature-dependent chemical shifts of 129Xe in the limit of zero mole fraction of Xe in O2 gas.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::9711775d77934e31a56d39a9b8273549 https://doi.org/10.1080/00268970500525614 Zobrazit plný text záznamu