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• W2004201320 abstract "Neutron scattering measurements and molecular dynamics simulations have been carried out on the three isomers of pentane (neopentane (neo), isopentane (iso), and n-pentane (n-)) adsorbed in zeolite NaY. The results show that the self-diffusivity of these isomers follow the order Ds(neo) > Ds(iso) > Ds(n-), suggesting that the larger the cross section perpendicular to the molecular axis of the isomer, the higher the self-diffusivity. This counterintuitive result provides the first direct experimental evidence in support of the mutual cancellation of forces on the diffusant leading to a diffusivity maximum and is often referred to as the levitation effect. We also provide a direct confirmation of the experimental observations by Kemball (Adv. Catal. 1950, 2, 233) by calculating the entropy." @default.
• W2004201320 created "2016-06-24" @default.
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• W2004201320 date "2009-08-31" @default.
• W2004201320 modified "2023-09-25" @default.
• W2004201320 title "Neutron Scattering and Molecular Dynamics Evidence for Levitation Effect in Nanopores" @default.
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• W2004201320 doi "https://doi.org/10.1021/jp907453a" @default.
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