Title of article :
A coupled cluster calculation of the spectrum of urea
Author/Authors :
S?nchez de Mer?s، نويسنده , , Alfredo M.J and Cuesta، نويسنده , , Inmaculada Garc??a and Koch، نويسنده , , Henrik، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2001
Pages :
8
From page :
469
To page :
476
Abstract :
Several coupled cluster methods have been used to compute the vertical excitation energies and oscillator strengths of the lowest singlet states of urea. Except for one excitation, the results are in good agreement with experiment, but previously non-detected transitions have been found.
Journal title :
Chemical Physics Letters
Serial Year :
2001
Journal title :
Chemical Physics Letters
Record number :
1778449
Link To Document :
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