CHBC Faculty Publications

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Author: Chuma, Anthony Mwangi

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TitlePublication NamePub. TypeYear
Two applications of computational spectroscopy: IR spectra of polycyclic aromatic hydrocarbons, and protein structural information from NMR shiftsAbstracts of Papers of the American Chemical SocietyAbstract2008
The performance of the Handy/Cohen functionals, OLYP and O3LYP, for the computation of hydrocarbon pericyclic reaction activation barriersJournal of Physical Chemistry AJournal Article2004