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Computer-assisted screening of ordered crystalline nanoporous adsorbents for separation of alkane isomers.

Dubbeldam, D, Krishna, R, Calero, S and Yazaydın, A (2012) Computer-assisted screening of ordered crystalline nanoporous adsorbents for separation of alkane isomers. Angew Chem Int Ed Engl, 51 (47). pp. 11867-11871.

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Abstract

A matter of degree: Separation of di-branched alkanes from their linear and mono-branched isomers is important in producing high-octane gasoline. Using computational techniques to screen a large variety of adsorbent materials, ZIF-77 emerges as the best adsorbent. It has the unique ability to fractionate isomer mixtures according to the degree of branching.

Item Type: Article
Authors :
NameEmailORCID
Dubbeldam, DUNSPECIFIEDUNSPECIFIED
Krishna, RUNSPECIFIEDUNSPECIFIED
Calero, SUNSPECIFIEDUNSPECIFIED
Yazaydın, AUNSPECIFIEDUNSPECIFIED
Date : 19 November 2012
Identification Number : 10.1002/anie.201205040
Depositing User : Symplectic Elements
Date Deposited : 17 May 2017 12:35
Last Modified : 17 May 2017 12:35
URI: http://epubs.surrey.ac.uk/id/eprint/835958

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