Density Functional Theory Investigation of the Contributions of π–π Stacking and Hydrogen-Bonding Interactions to the Aggregation of Model Asphaltene Compounds-Reference-Cited by-同舟云学术

Density Functional Theory Investigation of the Contributions of π–π Stacking and Hydrogen-Bonding Interactions to the Aggregation of Model Asphaltene Compounds

Published:2012-01-20 Issue:5 Volume:26 Page:2727-2735
ISSN:0887-0624
Container-title:Energy & Fuels
language:en
Short-container-title:Energy Fuels

Author:

da Costa Leonardo M.¹²,Stoyanov Stanislav R.¹,Gusarov Sergey¹,Tan Xiaoli,Gray Murray R.,Stryker Jeffrey M.,Tykwinski Rik³,de M. Carneiro J. Walkimar²,Seidl Peter R.⁴,Kovalenko Andriy¹

Affiliation:

1. National Institute for Nanotechnology, National Research Council of Canada, 11421 Saskatchewan Drive, Edmonton, Alberta T6G 2M9, Canada

2. Institute of Chemistry, Universidade Federal Fluminense, Niteroi, 24020-150 Rio de Janeiro, Brazil

3. Department of Chemistry and Pharmacy, Friedrich-Alexander-Universität Erlangen-Nürnberg, 91054 Erlangen, Germany

4. Department of Organic Processes, Institute of Chemistry, Universidade Federal do Rio de Janeiro, 21949-900 Rio de Janeiro, Brazil

Publisher

American Chemical Society (ACS)

Subject

Energy Engineering and Power Technology,Fuel Technology,General Chemical Engineering

Link

https://pubs.acs.org/doi/pdf/10.1021/ef202010p

Reference52 articles.

1. Petroleum AsphalteneProperties, Characterization, and Issues

2. Wiehe, I. A.Process Chemistry of Petroleum Macromolecules;CRC Press:Boca Raton, FL, 2008; Vol.121, p427.

3. Molecular Size and Structure of Asphaltenes from Various Sources

4. Modeling Solvent Effects on Asphaltene Dimers

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