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Ring currents in boron and carbon buckyballs, B80 and C60.
Bean DE, Muya JT, Fowler PW, Nguyen MT, Ceulemans A. Bean DE, et al. Among authors: nguyen mt. Phys Chem Chem Phys. 2011 Dec 14;13(46):20855-62. doi: 10.1039/c1cp22521a. Epub 2011 Oct 17. Phys Chem Chem Phys. 2011. PMID: 22005663
Theoretical study on the group 2 atoms + N2O reactions.
Tishchenko O, Vinckier C, Ceulemans A, Nguyen MT. Tishchenko O, et al. Among authors: nguyen mt. J Phys Chem A. 2005 Jul 14;109(27):6099-103. doi: 10.1021/jp050466+. J Phys Chem A. 2005. PMID: 16833947
A unified perspective on the hydrogen atom transfer and proton-coupled electron transfer mechanisms in terms of topographic features of the ground and excited potential energy surfaces as exemplified by the reaction between phenol and radicals.
Tishchenko O, Truhlar DG, Ceulemans A, Nguyen MT. Tishchenko O, et al. Among authors: nguyen mt. J Am Chem Soc. 2008 Jun 4;130(22):7000-10. doi: 10.1021/ja7102907. Epub 2008 May 9. J Am Chem Soc. 2008. PMID: 18465862
1,244 results