Comparison of CIS- and EOM-CCSD-Calculated Adiabatic...

Journal of Physical Chemistry A 2005 / 01 Vol. 109; Iss. 3

Comparison of CIS- and EOM-CCSD-Calculated Adiabatic Excited-State Structures. Changes in Charge Density on Going to Adiabatic Excited States

Wiberg, Kenneth B., Wang, Yi-gui, de Oliveira, Anselmo E., Perera, S. Ajith, Vaccaro, Patrick H.
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Volume:
109
Language:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/jp040558j
Date:
January, 2005
File:
PDF, 1.54 MB
english, 2005
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