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- W1963637391 abstract "A synthetic H·MFI material presenting the H1.30Al1.30Si94.70O192 framework composition and containing 2.2C6D6 molecules sorbed at low pore-filling has been studied at room temperature by neutron powder diffraction (ILL, Grenoble, D2B diffractometer, λ = 2.4Å). The experimental profile was analysed by combining profile-fitting structure refinements (Rietveld method with geometric restraints), interpretation of difference-Fourier maps and energy-minimization calculations using the atom-atom potential method (Buckingham model). At low pore-filling (<4 molecules/unit-cell), the deuterobenzene species are localized and disordered at the channel-intersections. This statistical orientational disorder can be modelled by considering two limiting orientations of the benzene molecules." @default.
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- W1963637391 date "1993-08-01" @default.
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- W1963637391 title "Location of perdeuterated benzene sorbed at low pore-filling in a H·MFI material: A neutron powder diffraction study" @default.
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- W1963637391 doi "https://doi.org/10.1016/0025-5408(93)90017-8" @default.
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