Ultrafast energy flow in the wake of solution-phase bimolecular reactions
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چکیده
منابع مشابه
Ultrafast energy flow in the wake of solution-phase bimolecular reactions.
Vibrational energy flow into reactants, and out of products, plays a key role in chemical reactivity, so understanding the microscopic detail of the pathways and rates associated with this phenomenon is of considerable interest. Here, we use molecular dynamics simulations to model the vibrational relaxation that occurs during the reaction CN + c-C(6)H(12) → HCN + c-C(6)H(11) in CH(2)Cl(2), whic...
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ژورنال
عنوان ژورنال: Nature Chemistry
سال: 2011
ISSN: 1755-4330,1755-4349
DOI: 10.1038/nchem.1154