Ab initio and DFT study on the electrophilic addition reaction of bromine to tetracyclo[5.3.0.02,6.03,10]deca–4,8–diene

2006 ◽  
Vol 12 (6) ◽  
pp. 991-995 ◽  
Author(s):  
Rza Abbasoglu
Keyword(s):  
Ab Initio ◽  
Addition Reaction ◽  
Electrophilic Addition ◽  
Dft Study ◽  
Electrophilic Addition Reaction ◽  
Ab Initio And Dft

scholarly journals Ab Initio and DFT Study of the Conformational Energy Hypersurface of Cyclic Gly-Gly-Gly

2009 ◽  
Vol 113 (40) ◽  
pp. 10818-10825 ◽  
Author(s):  
Rodrigo D. Tosso ◽  
Miguel A. Zamora ◽  
Fernando D. Suvire ◽  
Ricardo D. Enriz
Keyword(s):  
Ab Initio ◽  
Conformational Energy ◽  
Dft Study ◽  
Energy Hypersurface ◽  
Ab Initio And Dft

Ab initio and DFT study of the dipole (hyper) polarizabilities of p-nitrophenylphosphine molecule

2012 ◽  
Vol 12 (4-6) ◽  
pp. 407-421
Author(s):  
Johan Urdaneta ◽  
Yaneth Bermúdez ◽  
Ricardo Bracho ◽  
Roxana Moreno ◽  
Humberto Soscún
Keyword(s):  
Ab Initio ◽  
Dft Study ◽  
Ab Initio And Dft
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