Mobility and separation of linear and branched C<sub>5</sub> alkanes in UiO-66 (Zr) probed by <sup>2</sup>H NMR and MD simulations

Khudozhitkov, Alexander E.; Plekhanov, Mikhail S.; Arzumanov, Sergei S.; Kolokolov, Daniil I.; Stepanov, Alexander G.

doi:10.1039/d3cp02601a

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Mobility and separation of linear and branched C₅ alkanes in UiO-66 (Zr) probed by ²H NMR and MD simulations

Abstract: Kinetic and thermodynamic separation of n-pentane and isopentane isomers by a dehydroxylated UiO-66 (Zr) metal–organic framework is explored using 2H NMR coupled with molecular dynamics (MD, GCMC MD) simulations.

Cited by 2 publications

References 39 publications

Impact of the material hydroxylation on the possibility of pentane isomers separation by UiO-66 (Zr) MOF: A combined 2H NMR and MD study

Impact of the material hydroxylation on the possibility of pentane isomers separation by UiO-66 (Zr) MOF: A combined 2H NMR and MD study

Impact Of Material Hydroxylation on the Possibility Of Pentane Isomers Separation by Uio-66 (Zr) Mof: A Combined 2h Nmr and Md Study

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Mobility and separation of linear and branched C5 alkanes in UiO-66 (Zr) probed by 2H NMR and MD simulations

Abstract: Kinetic and thermodynamic separation of n-pentane and isopentane isomers by a dehydroxylated UiO-66 (Zr) metal–organic framework is explored using 2H NMR coupled with molecular dynamics (MD, GCMC MD) simulations.

Cited by 2 publications

References 39 publications

Impact of the material hydroxylation on the possibility of pentane isomers separation by UiO-66 (Zr) MOF: A combined 2H NMR and MD study

Impact of the material hydroxylation on the possibility of pentane isomers separation by UiO-66 (Zr) MOF: A combined 2H NMR and MD study

Impact Of Material Hydroxylation on the Possibility Of Pentane Isomers Separation by Uio-66 (Zr) Mof: A Combined 2h Nmr and Md Study

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Product

Resources

About

Mobility and separation of linear and branched C₅ alkanes in UiO-66 (Zr) probed by ²H NMR and MD simulations