Title of article :
Theoretical study on the ionization of aniline in aqueous solutions
Author/Authors :
Matsumura، نويسنده , , Yoshihiro and Iida، نويسنده , , Kenji and Sato، نويسنده , , Hirofumi، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2013
Pages :
5
From page :
103
To page :
107
Abstract :
The ionization and excitation processes of aniline in aqueous solutions are investigated by the method of RISM-SCF-SEDD (reference interaction site model self-consistent field with the spatial electron density distribution). Four different models are employed to characterize the response of the solvation upon the ionization and excitation. A simple treatment for estimation of the spectral width is also proposed.
Journal title :
Chemical Physics Letters
Serial Year :
2013
Journal title :
Chemical Physics Letters
Record number :
1935501
Link To Document :
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