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Research Publications:  Simulations of Xe distributions and chemical shifts in cages

COLLABORATORS

Bernoli I. Baello
    Science & Math Faculty
    Northridge Preparatory
    School, Niles, IL
Rex E. Gerald II
    Univ Missouri-Rolla
A. Keith Jameson
Pavel Kostikin
    Bruker Biospin
Hyung-Mi Lim
    KICET, Seoul
Alex Pines
    Univ California-Berkeley
E. Janette Ruiz
    Lam Research Corp
Devin N. Sears
    Gilead Sciences, Canada
Dirk Stueber
    Merck Research Labs

TALKS ON THIS TOPIC

Xe in the cages of a hydrogen-bonded network Xe chemical shift tensors in clathrate hydrates Xe in cryptophane cages
Other talks on this topic

125. Grand canonical Monte Carlo simulations of xenon in zeolite NaA, I. Distribution and 129Xe chemical shifts, C. J. Jameson, A. K. Jameson, B. I. Baello and H. M. Lim, J. Chem. Phys. 100, 5965-5976 (1994).
126. Grand canonical Monte Carlo simulations of xenon in zeolite NaA, II. Structure of the adsorbed fluid, C. J. Jameson, A. K. Jameson, H. M. Lim, and B. I. Baello, J. Chem. Phys. 100, 5977-5987 (1994).
136. Xen clusters in the alpha cages of zeolite KA, C. J. Jameson, A. K. Jameson, R. E. Gerald II, and H.-M Lim, J. Chem. Phys. 103, 8811-8820 (1995).
141. Competitive adsorption of xenon and argon in zeolite NaA. 129Xe NMR and grand canonical Monte Carlo simulations, C. J. Jameson, A. K. Jameson, and H. M. Lim, J. Chem. Phys. 104, 1709-1728 (1996).
149. Distribution and 129Xe chemical shifts of Xen clusters in the alpha cages of zeolite AgA, C. J. Jameson and H. M. Lim, J. Chem. Phys. 107, 4373-4383 (1997).
150. Competitive adsorption of xenon and krypton in zeolite NaA. 129Xe NMR and grand canonical Monte Carlo simulations, C. J. Jameson, A. K. Jameson, and H. M. Lim, J. Chem. Phys. 107, 4364-4372 (1997).
152. The role of polarization of Xe by di- and monovalent cations in 129Xe NMR studies in zeolite A, C. J. Jameson, H. M. Lim, and A. K. Jameson, Solid State Nucl. Magn. Reson. 9, 277-301 (1997).
159. Application of Nuclear Shielding Surfaces to the Fundamental Understanding of Adsorption and Diffusion in Microporous Solids , C. J. Jameson, A. K. Jameson, A. C. de Dios, R. E. Gerald II, H. M. Lim, P. Kostikin, Modeling NMR Chemical Shifts: Gaining Insights into Structure and Environment, ACS Symposium Series 732, ed. J. C. Facelli and A. C. de Dios, Oxford University Press, Oxford, 1999, pp. 335-348.
162. Adsorption of xenon and CH4 mixtures in zeolite NaA. 129Xe NMR and grand canonical Monte Carlo simulations, C. J. Jameson, A. K. Jameson, P. Kostikin, and B. I. Baello, J. Chem. Phys. 112, 323-334 (2000).
169. Calculation of the Xe chemical shift in Xe@C60, D. N. Sears and C. J. Jameson, J. Chem. Phys. 118 , 9987-9989 (2003).
174. Theoretical calculations of Xe chemical shifts in cryptophane cages, D. N. Sears and C. J. Jameson, J. Chem. Phys. 119, 12231-12244 (2003).
175. The chemical shifts of Xe in the cages of clathrate hydrate Structure I and II, D. Stueber and C. J. Jameson, J. Chem. Phys. 120, 1560-1571 (2004).
178. The NMR lineshapes of Xe in the cages of clathrate hydrates, C. J. Jameson and D. Stueber, J. Chem. Phys. 120, 10200-10214 (2004).
179. Is there a spatial correlation in the distribution of adsorbed atoms in the cages of a zeolite?, C. J. Jameson, Mol. Phys. 102, 723-727 (2004).
191. Diastereomeric Xe chemical shifts in tethered cryptophane cages, E. J. Ruiz, D. N. Sears, A. Pines, and C. J. Jameson, J. Am. Chem. Soc. 128, 16980-16988 (2006).
215. The Xe chemical shift and chemical shift anisotropy, Cynthia J. Jameson, a chapter in Hyperpolarized Xenon-129 Magnetic Resonance: Concepts, Production, Techniques and Applications, Eike Brunner and Thomas Meersman, eds., Royal Society of Chemistry, London, 2015.

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