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Adsorptive desulfurization with CPO-27/MOF-74: an experimental and computational investigation

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F00216208%3A11310%2F15%3A10293719" target="_blank" >RIV/00216208:11310/15:10293719 - isvavai.cz</a>

  • Result on the web

    <a href="http://pubs.rsc.org/en/content/articlepdf/2015/cp/c5cp01063b" target="_blank" >http://pubs.rsc.org/en/content/articlepdf/2015/cp/c5cp01063b</a>

  • DOI - Digital Object Identifier

    <a href="http://dx.doi.org/10.1039/c5cp01063b" target="_blank" >10.1039/c5cp01063b</a>

Alternative languages

  • Result language

    angličtina

  • Original language name

    Adsorptive desulfurization with CPO-27/MOF-74: an experimental and computational investigation

  • Original language description

    By combining experimental adsorption isotherms, microcalorimetric data, infrared spectroscopy and quantum chemical calculations the adsorption behaviour of the CPO-27/MOF-74 series (Ni, Co, Mg, Cu, and Zn) in the desulfurization of fuels is evaluated. The results show a clear influence of the metal ion on the adsorption capacity and affinity for S-heterocyclic compounds, with CPO-27(Ni) being the best performing material both in terms of capacity and affinity. The microcalorimetric data and infrared spectroscopy confirm the high affinity of CPO-27(Ni) for thiophene and similar compounds, while the computational data reveal that the origin of this outstanding adsorption performance is the strong sulfur-metal interaction.

  • Czech name

  • Czech description

Classification

  • Type

    J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)

  • CEP classification

    CF - Physical chemistry and theoretical chemistry

  • OECD FORD branch

Result continuities

  • Project

    <a href="/en/project/GA14-07101S" target="_blank" >GA14-07101S: Combined Experimental and Theoretical Investigation of Catalytic Properties of Metal Organic Frameworks</a><br>

  • Continuities

    I - Institucionalni podpora na dlouhodoby koncepcni rozvoj vyzkumne organizace

Others

  • Publication year

    2015

  • Confidentiality

    S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Data specific for result type

  • Name of the periodical

    Physical Chemistry Chemical Physics

  • ISSN

    1463-9076

  • e-ISSN

  • Volume of the periodical

    17

  • Issue of the periodical within the volume

    16

  • Country of publishing house

    GB - UNITED KINGDOM

  • Number of pages

    8

  • Pages from-to

    10759-10766

  • UT code for WoS article

    000352707200048

  • EID of the result in the Scopus database

    2-s2.0-84927932695