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Grantee Research Project Results

Selected Publications Details for Grant Number R828169

Engineering Environmentally Benign Solvent Systems

RFA: Exploratory Research - Engineering, Chemistry, and Physics) (1999)

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Journal Article (5)
Reference Type Citation Progress Report Year Document Sources
Journal Article Kahn S, Zhang O, Broadbelt L. Automated mechanism generation. Part 1:mechanism development and rate constant estimation for VOC chemistry in the atmosphere. JOURNAL OF ATMOSPHERIC CHEMISTRY 2009;63(2):125-156. R828169 (Final)
  • Full-text: Springer - Full Text HTML
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  • Other: Springer - Full Text PDF
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Journal Article Kahn S, Broadbelt L. Automated mechanism generation. Part 2:application to atmospheric chemistry of alkanes and oxygenates. JOURNAL OF ATMOSPHERIC CHEMISTRY 2009;63(2):157-186. R828169 (Final)
  • Full-text: Springer - Full Text HTML
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  • Other: Springer - Full Text PDF
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Journal Article Khan SS, Broadbelt LJ. A group additivity approach for the prediction of wavelength-dependent absorption cross-sections. Atmospheric Environment 2004;38(7):1015-1022. R828169 (Final)
  • Full-text: ScienceDirect - Full Text PDF
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  • Abstract: ScienceDirect-Abstract & Full Text HTML
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  • Other: ResearchGate - Abstract
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Journal Article Khan SS, Yu X, Wade JR, Malmgren D, Broadbelt LJ. Thermochemistry of radicals and molecules relevant to atmospheric chemistry: determination of group additivity values using G3//B3LYP theory. Journal of Physical Chemistry A 2009;113(17):5176-5194. R828169 (Final)
  • Abstract from PubMed
  • Full-text: ResearchGate - Abstract & Full Text PDF
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  • Abstract: ACS-Abstract
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Journal Article Khan SS, Zhang Q, Broadbelt LJ. Automated mechanism generation. Part 1: Mechanism development and rate constant estimation for VOC chemistry in the atmosphere. Journal of Atmospheric Chemistry 2009;63(2):125-156. R828169 (Final)
  • Abstract: Springer-Abstract
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The perspectives, information and conclusions conveyed in research project abstracts, progress reports, final reports, journal abstracts and journal publications convey the viewpoints of the principal investigator and may not represent the views and policies of ORD and EPA. Conclusions drawn by the principal investigators have not been reviewed by the Agency.

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Last updated April 28, 2023
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