Abstract
The structure of the electronically excited formaldehyde in water was studied using polarizable mixed Hamiltonian model. The vertical absorption energy showed a blue shift between ∼1000 cm-1 and ∼2500 cm-1 due to solvation. The results showed that the dipole moments of the ground and excited states increased with the degree of solvation.
Original language | English |
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Pages (from-to) | 1256-1268 |
Number of pages | 13 |
Journal | Journal of Chemical Physics |
Volume | 117 |
Issue number | 3 |
DOIs | |
Publication status | Published - Jul 15 2002 |
ASJC Scopus subject areas
- Physics and Astronomy(all)
- Physical and Theoretical Chemistry