| 1 |
Study of the Structural and Electronic Properties of Valproic Acid and New Derivatives Used As Anticonvulsant Agents
Comelli NC, Lobayan RM, Castro EA, Jubert AH
Journal of Physical Chemistry A, 115(9), 1686, 2011 |
| 2 |
Calorimetric and computational study of enthalpy of formation of diperoxide of cyclohexanone
Romero JM, Bustillo S, Maisuls HER, Jorge NL, Vara MEG, Castro EA, Jubert AH
International Journal of Molecular Sciences, 8(7), 688, 2007 |
| 3 |
Three-center-two-electron and four-center-four-electron bonds. A study by electron charge density over the structure of methonium cations
Okulik NB, Peruchena NM, Jubert AH
Journal of Physical Chemistry A, 110(32), 9974, 2006 |
| 4 |
Some electronic correlation effects in the topological analysis of the Laplacian of the electronic charge density in C-n-butonium cations
Lobayan RM, Sosa GL, Jubert AH, Peruchena NN
Journal of Physical Chemistry A, 109(1), 181, 2005 |
| 5 |
A topological study of the transition states of the hydrogen exchange and dehydrogenation reactions of ethane on a zeolite cluster
Okulik NB, Diez RP, Jubert AH
Journal of Physical Chemistry A, 108(13), 2469, 2004 |
| 6 |
Exploratory topological study of the Laplacian of the electronic charge density in n-butonium cations
Lobayan RM, Sosa GL, Jubert AH, Peruchena NM
Journal of Physical Chemistry A, 108(19), 4347, 2004 |
| 7 |
Topological study of the effect of the isomorphic substitution of silicon by aluminum on the zeolite structure and its interaction with methane
Okulik NB, Diez RP, Jubert AH
Journal of Physical Chemistry A, 107(32), 6225, 2003 |
| 8 |
Ab initio topological analysis of the electronic density in n-butonium cations and their van der Waals complexes
Okulik NB, Sosa LG, Esteves PM, Mota CJA, Jubert AH, Peruchena NM
Journal of Physical Chemistry A, 106(8), 1584, 2002 |
| 9 |
A topological study of the transition states of the hydrogen exchange and dehydrogenation reactions of methane on a zeolite cluster
Okulik NB, Diez RP, Jubert AH, Esteves PM, Mota CJA
Journal of Physical Chemistry A, 105(29), 7079, 2001 |
| 10 |
Ab initio topological analysis of the electronic density in proponium cations
Okulik N, Peruchena N, Esteves PM, Mota C, Jubert AH
Journal of Physical Chemistry A, 104(32), 7586, 2000 |
