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Solvation dynamics of the fluorenone radical anion by methanol: a direct MO dynamics study

✍ Scribed by Hiroto Tachikawa


Book ID
114142678
Publisher
Elsevier Science
Year
1998
Tongue
English
Weight
542 KB
Volume
427
Category
Article
ISSN
0166-1280

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## Abstract By means of the dual‐level direct dynamics method, the mechanisms of the reactions, CH~3~CF~2~Cl + OH β†’ products (R1) and CH~3~CFCl~2~ + OH β†’ products (R2), are studied over a wide temperature range 200–2000 K. The optimized geometries and frequencies of the stationary points are calcul