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Transport Properties of Light Gases in Nanochannels of L-Leu-L-Ser Dipeptide Crystals: A Comparative Study by Molecular Dynamics Simulations

Title
Transport Properties of Light Gases in Nanochannels of L-Leu-L-Ser Dipeptide Crystals: A Comparative Study by Molecular Dynamics Simulations
Type
Article in International Scientific Journal
Year
2018
Authors
Krzysztof Biernacki
(Author)
FCUP
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Sergio Filipe Sousa
(Author)
FCUP
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Luis Gales
(Author)
ICBAS
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Ramos, MJ
(Author)
FCUP
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Magalhaes, AL
(Author)
FCUP
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Journal
Title: ChemistrySelectImported from Authenticus Search for Journal Publications
Vol. 3
Pages: 5517-5525
Publisher: Wiley-Blackwell
Other information
Authenticus ID: P-00P-Q3K
Abstract (EN): Dipeptide crystals are stable microporous organic materials which have shown potential to be applied on storage and selective separation techniques with lower environmental impact than other traditional inorganic materials. We present a Molecular Dynamics study on the flow of gas molecules, namely Ar, N-2, O-2, CH4, CO and CO2 through porous L-Leucyl-L-Serine (LS) crystals, at 298K and elevated pressures, when nanochannels are under saturation conditions.
Language: English
Type (Professor's evaluation): Scientific
No. of pages: 9
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