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Browsing by Author Geerlings P.

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Issue DateTitleAuthor(s)
2003A theoretical approach to the regioselectivity in 1,3-dipolar cycloadditions of diazoalkanes, hydrazoic acid and nitrous oxide to acetylenes, phosphaalkynes and cyanidesNguyen L.T.; De Proft F.; Dao V.L.; Nguyen M.T.; Geerlings P.
2003Local softness versus local density of states as reactivity indexNguyen L.T.; De Proft F.; Amat M.C.; Van Lier G.; Fowler P.W.; Geerlings P.
1999Mechanism of [2 + 1] cycloadditions of hydrogen isocyanide to alkynes: Molecular orbital and density functional theory studyNguyen L.T.; Le T.N.; De Proft F.; Chandra A.K.; Langenaeker W.; Nguyen M.T.; Geerlings P.
2001Theoretical study of cyclopropenones and cyclopropenethiones: Decomposition via intermediatesNguyen L.T.; De Proft F.; Nguyen M.T.; Geerlings P.
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