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Excited-State Hydrogen Bonding Dynamics of Hydrogen-Bonded Clusters Formed by of Coumarin Derivatives in Aqueous Solution: A Time-Dependent Density Functional Theory Study

✍ Scribed by Zhang, Mingzhen; Zhao, Changxin; Wang, Yi

Book ID: 113070615
Publisher: Springer
Year: 2012
Tongue: English
Weight: 384 KB
Volume: 23
Category: Article
ISSN: 1040-7278
DOI: 10.1007/s10876-012-0466-y

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## Abstract The time‐dependent density functional theory (TDDFT) method has been carried out to investigate the excited‐state hydrogen‐bonding dynamics of 4‐aminophthalimide (4AP) in hydrogen‐donating water solvent. The infrared spectra of the hydrogen‐bonded solute−solvent complexes in electronica