화학공학소재연구정보센터
검색결과 : 19건
No. Article
1 Lewis Molecular Acidity of Ionic Liquids from Empirical Energy-Density Models
Contreras R, Aizman A, Tapia RA, Cerda-Monje A
Journal of Physical Chemistry B, 117(6), 1911, 2013
2 Permanent group effect on nucleofugality in aryl benzoates
Campodonico PR, Ormazabal-Toledo R, Aizman A, Contreras R
Chemical Physics Letters, 498(1-3), 221, 2010
3 Invariance of electrophilicity of independent fragments. Application to intramolecular Diels-Alder reactions
Soto-Delgado J, Aizman A, Domingo LR, Contreras R
Chemical Physics Letters, 499(4-6), 272, 2010
4 Substituent effects in the mechanism of mono-substituted acetylene trimerization: A topological analysis of the electron localization function
Donoso-Tauda O, Aizman A, Escobar CA, Santos JC
Chemical Physics Letters, 469(1-3), 219, 2009
5 Electrophilicity of quinones and its relationship with hydride affinity
Campodonico PR, Aizman A, Contreras R
Chemical Physics Letters, 471(1-3), 168, 2009
6 On the Principle of Spin Potential Equalization
Guerra D, Contreras R, Cedillo A, Aizman A, Fuentealba P
Journal of Physical Chemistry A, 113(7), 1390, 2009
7 Two state reactivity mechanism for the rearrangement of hydrogen peroxynitrite to nitric acid
Contreras R, Galvan M, Oliva M, Safont VS, Andres J, Guerra D, Aizman A
Chemical Physics Letters, 457(1-3), 216, 2008
8 Proton transport catalysis in intramolecular rearrangements: A density functional theory study
Campodonico PR, Andres J, Aizman A, Contreras R
Chemical Physics Letters, 464(4-6), 271, 2008
9 Nucleofugality index in alpha-elimination reactions
Campodonico PR, Andres J, Aizman A, Contreras R
Chemical Physics Letters, 439(1-3), 177, 2007
10 beta-Scission of thioimidoyl radicals (R-1-N-C-center dot=S-R-2): A theoretical scale of radical leaving group ability
Guerra D, Fuentealba P, Aizman A, Contreras R
Chemical Physics Letters, 443(4-6), 383, 2007