Research Interests
Recent activity has involved collaboration in an international project to conduct
service-based chemistry research for improvement
of coffee quality with Nicaraguan small-holder coffee farmers. This project has involved field work on farms
in
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The coffee service project has been expanded to include work on an international team, organized by the Global Knowledge Initiative, that is focused on solving the "potato taste" defect sometimes found in Rwandan coffee.
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Prior to the initiation of the coffee chemistry research, work in my laboratory had primarily focused on application of computational science methods to chemical and physical problems involving the ground and excited state properties of small molecules, especially those that are of importance in Earth's atmosphere. Recent ab initioquantum chemical studies have focused on the overtone vibrational spectrum of ethanol and the photolysis of Cl2O2. The studies have employed large-scale CASSCF, configuration interaction, and perturbation theory calculations. |
Recent Presentations
Recent Publications
“GCMS Investigation of Volatile Compounds in Green Coffee Affected by Potato Taste Defect and the Antestia Bug” Susan Jackels, Eric Marshall, Angelica Omaiye, Robert Gianan, Fabrice Lee, and Charles Jackels. J. Agric Food Chem. 62(42), pp 10222-10229 (2014)
“Coffee for Justice.” Susan C. Jackels, Charles F. Jackels, Carlos Vallejos, and Michael Marsolek. In: Combs MB and Schmidt PR, editors. Transforming Ourselves, Transforming the World: Justice in Jesuit Higher Education. New York: Fordham University Press; 2013. p. 137-160.
“Wastewater Treatment for a Coffee Processing Mill in Nicaragua: A Service-Learning Design Project,” Michael D. Marsolek, Patrick Cummings, Joshua T. Alcantara, Michael Wynne, Luis Quintero, Carlos Vallejos, Charles F. Jackels, and Susan C. Jackels. Int. J. Service Learning in Engineering 7(1), pp. 67-92 (2012)
"Conntrol of the Coffee Fermentation Process and Quality of Resulting Roasted Coffee: Studies in the Field Laboratory and on Small Farms in Nicaragua During the 2005-06 Harvest." S. Jackels, C. Jackels, C. Vallejos, S. Kleven, R. Rivas, and S. Fraser-Dauphinee. Proceedings of the 21st ASIC (Association Scientifique Internationale du Café) Meeting (Montpelier) 2006, pp. 434 – 442 (2006)
“Characterization of the Coffee Mucilage Fermentation Process Using Chemical Indicators: A Field Study in Nicaragua,” Susan C. Jackels and Charles F. Jackels, J. Food Science 70, C321-5 (2005).
“Experimental
and ab initio
investigation of the O-H overtone vibration in ethanol.”, Jason D.
Weibel, Charles F. Jackels, and
Robert L. Swofford, J. Chem. Phys. 117, 4245
(2002)