Shumaila S. Khan, Ph.D. - Publications
Affiliations: | Northwestern University, Evanston, IL |
Area:
multiscale modeling, complex kinetics modeling, environmental catalysis, novel biochemical pathways, and polymerization/depolymerization kineticsYear | Citation | Score | |||
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2009 | Khan SS, Yu X, Wade JR, Malmgren RD, 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. 113: 5176-5194. PMID 19338326 DOI: 10.1021/Jp809361Y | 0.613 | |||
2009 | 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. 63: 125-156. DOI: 10.1007/S10874-010-9164-Z | 0.543 | |||
2009 | Khan SS, Broadbelt LJ. Automated mechanism generation. Part 2: Application to atmospheric chemistry of alkanes and oxygenates Journal of Atmospheric Chemistry. 63: 157-186. DOI: 10.1007/S10874-010-9162-1 | 0.526 | |||
2004 | Khan SS, Broadbelt LJ. A group additivity approach for the prediction of wavelength-dependent absorption cross-sections Atmospheric Environment. 38: 1015-1022. DOI: 10.1016/J.Atmosenv.2003.10.054 | 0.54 | |||
2002 | Kruse TM, Woo OS, Wong HW, Khan SS, Broadbelt LJ. Mechanistic modeling of polymer degradation: A comprehensive study of polystyrene Macromolecules. 35: 7830-7844. DOI: 10.1021/Ma020490A | 0.419 | |||
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