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Extended coupled-cluster method. II. Excited states and generalized random-phase approximation

✍ Scribed by Arponen, J. S.; Bishop, R. F.; Pajanne, E.


Book ID
118215787
Publisher
The American Physical Society
Year
1987
Tongue
English
Weight
497 KB
Volume
36
Category
Article
ISSN
1050-2947

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## Abstract The theory for the analytical energy gradients of excited electronic state described by equation of motion couped‐cluster method (EOM‐CC) (Stanton, J Chem Phys, 1993, 99, 8840) has been generalized to molecules in solution within the polarizable continuum model (PCM) framework (Miertuš